LC PestiMix 4 10 µg/mL in Acetonitrile
Product Code
DRE-A50000804AL
CAS Number
89 AnalytesProduct Format
Mixture
Solvent
Acetonitrile
Product Categories
Pesticide and Metabolite Reference Materials , Dr. Ehrenstorfer, Pesticide & Metabolite Reference Materials and Research Chemicals
Product Type
Native/ParentShare product
- Product Name: LC PestiMix 4 10 µg/mL in Acetonitrile
- Product Code: DRE-A50000804AL
- Brand: Dr. Ehrenstorfer
Documentation
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Product Information
Analyte Data
Analyte Name
Measured Value
CAS Number
Molecular Structure
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InChI
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IUPAC
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(5EZ)-Selamectin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C43 H63 N O11
Molecular Weight
769.96
Accurate Mass
769.4401
SMILES
CO[C@H]1C[C@H](O[C@H]2[C@@H](C)\C=C\C=C\3/CO[C@@H]4C(=NO)C(=C[C@@H](C(=O)O[C@H]5C[C@@H](C\C=C\2/C)O[C@@]6(CC[C@H](C)[C@H](O6)C7CCCCC7)C5)[C@]34O)C)O[C@@H](C)[C@@H]1O
InChI
InChI=1S/C43H63NO11/c1-24-11-10-14-30-23-50-40-36(44-48)27(4)19-33(43(30,40)47)41(46)52-32-20-31(16-15-25(2)38(24)53-35-21-34(49-6)37(45)28(5)51-35)54-42(22-32)18-17-26(3)39(55-42)29-12-8-7-9-13-29/h10-11,14-15,19,24,26,28-29,31-35,37-40,45,47-48H,7-9,12-13,16-18,20-23H2,1-6H3/b11-10+,25-15+,30-14+,44-36?/t24-,26-,28-,31+,32-,33-,34-,35-,37-,38-,39-,40+,42+,43+/m0/s1
(Z)-Diniconazole
CAS Number
Alternate CAS Number
Unlabelled CAS Number
-
Molecular Formula
C15 H17 Cl2 N3 O
Molecular Weight
326.221
Accurate Mass
325.075
SMILES
CC(C)(C)C(O)\C(=C\c1ccc(Cl)cc1Cl)\n2cncn2
InChI
InChI=1S/C15H17Cl2N3O/c1-15(2,3)14(21)13(20-9-18-8-19-20)6-10-4-5-11(16)7-12(10)17/h4-9,14,21H,1-3H3/b13-6-
IUPAC
(Z)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol
1-(4-Nitrophenyl)-3-propylurea
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H13 N3 O3
Molecular Weight
223.23
Accurate Mass
223.0957
SMILES
CCCNC(=O)Nc1ccc(cc1)[N+](=O)[O-]
InChI
InChI=1S/C10H13N3O3/c1-2-7-11-10(14)12-8-3-5-9(6-4-8)13(15)16/h3-6H,2,7H2,1H3,(H2,11,12,14)
IUPAC
1-(4-nitrophenyl)-3-propylurea
2,3,5-Trimethacarb
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H15 N O2
Molecular Weight
193.24
Accurate Mass
193.1103
SMILES
CNC(=O)Oc1cc(C)cc(C)c1C
InChI
InChI=1S/C11H15NO2/c1-7-5-8(2)9(3)10(6-7)14-11(13)12-4/h5-6H,1-4H3,(H,12,13)
IUPAC
(2,3,5-trimethylphenyl) N-methylcarbamate
Abamectin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C48H72O14
Molecular Weight
873.08
Accurate Mass
1730.9688
SMILES
CO[C@H]1C[C@H](O[C@H]2[C@H](C)O[C@H](C[C@@H]2OC)O[C@H]3[C@@H](C)\C=C\C=C\4/CO[C@@H]5[C@H](O)C(=C[C@@H](C(=O)O[C@H]6C[C@@H](C\C=C\3/C)O[C@@]7(C6)O[C@H](C8CCCCC8)[C@@H](C)C=C7)[C@]45O)C)O[C@@H](C)[C@@H]1O
InChI
InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12+,27-15+,32-14+/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1
IUPAC
(2S,2a'E,2a1'S,4'E,5S,6R,6'S,7'S,8'E,11'R,15'S,17a'R,20'R,20a'R)-6-((S)-sec-butyl)-2a1',20'-dihydroxy-7'-(((2R,4S,5S,6S)-5-(((2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-5,6',8',19'-tetramethyl-2a1',5,6,6',7',10',11',14',15',17a',20',20a'-dodecahydro-2'H,17'H-spiro[pyran-2,13'-[11,15]methano[1,5]dioxacyclooctadecino[9,8,7-cd]benzofuran]-17'-one
Azaconazole
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H11 Cl2 N3 O2
Molecular Weight
300.14
Accurate Mass
299.0228
SMILES
Clc1ccc(c(Cl)c1)C2(Cn3cncn3)OCCO2
InChI
InChI=1S/C12H11Cl2N3O2/c13-9-1-2-10(11(14)5-9)12(18-3-4-19-12)6-17-8-15-7-16-17/h1-2,5,7-8H,3-4,6H2
IUPAC
1-[[2-(2,4-dichlorophenyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole
Azamethiphos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C9 H10 Cl N2 O5 P S
Molecular Weight
324.68
Accurate Mass
323.9737
SMILES
COP(=O)(OC)SCN1C(=O)Oc2cc(Cl)cnc12
InChI
InChI=1S/C9H10ClN2O5PS/c1-15-18(14,16-2)19-5-12-8-7(17-9(12)13)3-6(10)4-11-8/h3-4H,5H2,1-2H3
IUPAC
6-chloro-3-(dimethoxyphosphorylsulfanylmethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
Azinphos-methyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H12 N3 O3 P S2
Molecular Weight
317.32
Accurate Mass
317.0058
SMILES
COP(=S)(OC)SCN1N=Nc2ccccc2C1=O
InChI
InChI=1S/C10H12N3O3PS2/c1-15-17(18,16-2)19-7-13-10(14)8-5-3-4-6-9(8)11-12-13/h3-6H,7H2,1-2H3
IUPAC
3-(dimethoxyphosphinothioylsulfanylmethyl)-1,2,3-benzotriazin-4-one
Beflubutamid
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H17 F4 N O2
Molecular Weight
355.33
Accurate Mass
355.1195
SMILES
CCC(Oc1ccc(F)c(c1)C(F)(F)F)C(=O)NCc2ccccc2
InChI
InChI=1S/C18H17F4NO2/c1-2-16(17(24)23-11-12-6-4-3-5-7-12)25-13-8-9-15(19)14(10-13)18(20,21)22/h3-10,16H,2,11H2,1H3,(H,23,24)
IUPAC
N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide
Benoxacor
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H11 Cl2 N O2
Molecular Weight
260.12
Accurate Mass
259.0167
SMILES
CC1COc2ccccc2N1C(=O)C(Cl)Cl
InChI
InChI=1S/C11H11Cl2NO2/c1-7-6-16-9-5-3-2-4-8(9)14(7)11(15)10(12)13/h2-5,7,10H,6H2,1H3
IUPAC
2,2-dichloro-1-(3-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanone
Bixafen
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H12 Cl2 F3 N3 O
Molecular Weight
414.21
Accurate Mass
413.031
SMILES
Cn1cc(C(=O)Nc2ccc(F)cc2c3ccc(Cl)c(Cl)c3)c(n1)C(F)F
InChI
InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)
IUPAC
N-[2-(3,4-dichlorophenyl)-4-fluorophenyl]-3-(difluoromethyl)-1-methylpyrazole-4-carboxamide
Bromfenvinphos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H14 Br Cl2 O4 P
Molecular Weight
404.02
Accurate Mass
401.919
SMILES
CCOP(=O)(OCC)OC(=CBr)c1ccc(Cl)cc1Cl
InChI
InChI=1S/C12H14BrCl2O4P/c1-3-17-20(16,18-4-2)19-12(8-13)10-6-5-9(14)7-11(10)15/h5-8H,3-4H2,1-2H3
IUPAC
[2-bromo-1-(2,4-dichlorophenyl)ethenyl] diethyl phosphate
Chinomethionate
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H6 N2 O S2
Molecular Weight
234.30
Accurate Mass
233.9922
SMILES
Cc1ccc2nc3SC(=O)Sc3nc2c1
InChI
InChI=1S/C10H6N2OS2/c1-5-2-3-6-7(4-5)12-9-8(11-6)14-10(13)15-9/h2-4H,1H3
IUPAC
6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one
Chlorthiophos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11H15Cl2O3PS2
Molecular Weight
361.24
Accurate Mass
1079.8732
SMILES
CO[C@H]1C[C@H](O[C@H]2[C@@H](C)\C=C\C=C\3/CO[C@@H]4C(=NO)C(=C[C@@H](C(=O)O[C@H]5C[C@@H](C\C=C\2/C)O[C@@]6(CC[C@H](C)[C@H](O6)C7CCCCC7)C5)[C@]34O)C)O[C@@H](C)[C@@H]1O
InChI
InChI=1S/C11H15Cl2O3PS2/c1-4-14-17(18,15-5-2)16-10-6-9(13)11(19-3)7-8(10)12/h6-7H,4-5H2,1-3H3
IUPAC
O-(2,5-dichloro-4-(methylthio)phenyl) O,O-diethyl phosphorothioate
Chromafenozide
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C24 H30 N2 O3
Molecular Weight
394.51
Accurate Mass
394.2256
SMILES
Cc1cc(C)cc(c1)C(=O)N(NC(=O)c2cc(C)c3CCCOc3c2)C(C)(C)C
InChI
InChI=1S/C24H30N2O3/c1-15-10-16(2)12-19(11-15)23(28)26(24(4,5)6)25-22(27)18-13-17(3)20-8-7-9-29-21(20)14-18/h10-14H,7-9H2,1-6H3,(H,25,27)
IUPAC
N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-7-carbohydrazide
Cinidon-ethyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C19 H17 Cl2 N O4
Molecular Weight
394.25
Accurate Mass
393.0535
SMILES
CCOC(=O)\C(=C\c1cc(ccc1Cl)N2C(=O)C3=C(CCCC3)C2=O)\Cl
InChI
InChI=1S/C19H17Cl2NO4/c1-2-26-19(25)16(21)10-11-9-12(7-8-15(11)20)22-17(23)13-5-3-4-6-14(13)18(22)24/h7-10H,2-6H2,1H3/b16-10-
IUPAC
ethyl (Z)-2-chloro-3-[2-chloro-5-(1,3-dioxo-4,5,6,7-tetrahydroisoindol-2-yl)phenyl]prop-2-enoate
Climbazole
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H17 Cl N2 O2
Molecular Weight
292.76
Accurate Mass
292.0979
SMILES
CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n2ccnc2
InChI
InChI=1S/C15H17ClN2O2/c1-15(2,3)13(19)14(18-9-8-17-10-18)20-12-6-4-11(16)5-7-12/h4-10,14H,1-3H3
IUPAC
1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutan-2-one
Cloquintocet-1-methylhexyl ester
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H22 Cl N O3
Molecular Weight
335.83
Accurate Mass
335.1288
SMILES
CCCCCC(C)OC(=O)COc1ccc(Cl)c2cccnc12
InChI
InChI=1S/C18H22ClNO3/c1-3-4-5-7-13(2)23-17(21)12-22-16-10-9-15(19)14-8-6-11-20-18(14)16/h6,8-11,13H,3-5,7,12H2,1-2H3
IUPAC
heptan-2-yl 2-(5-chloroquinolin-8-yl)oxyacetate
Cyanofenphos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H14 N O2 P S
Molecular Weight
303.32
Accurate Mass
303.0483
SMILES
CCOP(=S)(Oc1ccc(cc1)C#N)c2ccccc2
InChI
InChI=1S/C15H14NO2PS/c1-2-17-19(20,15-6-4-3-5-7-15)18-14-10-8-13(12-16)9-11-14/h3-11H,2H2,1H3
IUPAC
4-[ethoxy(phenyl)phosphinothioyl]oxybenzonitrile
Cyprofuram
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H14 Cl N O3
Molecular Weight
279.72
Accurate Mass
279.0662
SMILES
Clc1cccc(c1)N(C2CCOC2=O)C(=O)C3CC3
InChI
InChI=1S/C14H14ClNO3/c15-10-2-1-3-11(8-10)16(13(17)9-4-5-9)12-6-7-19-14(12)18/h1-3,8-9,12H,4-7H2
IUPAC
N-(3-chlorophenyl)-N-(2-oxooxolan-3-yl)cyclopropanecarboxamide
Dialifos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H17 Cl N O4 P S2
Molecular Weight
393.85
Accurate Mass
393.0025
SMILES
CCOP(=S)(OCC)SC(CCl)N1C(=O)c2ccccc2C1=O
InChI
InChI=1S/C14H17ClNO4PS2/c1-3-19-21(22,20-4-2)23-12(9-15)16-13(17)10-7-5-6-8-11(10)14(16)18/h5-8,12H,3-4,9H2,1-2H3
IUPAC
2-(2-chloro-1-diethoxyphosphinothioylsulfanylethyl)isoindole-1,3-dione
Dimethachlor
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C13 H18 Cl N O2
Molecular Weight
255.74
Accurate Mass
255.1026
SMILES
COCCN(C(=O)CCl)c1c(C)cccc1C
InChI
InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3
IUPAC
2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide
Dimethenamid
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H18 Cl N O2 S
Molecular Weight
275.79
Accurate Mass
275.0747
SMILES
COCC(C)N(C(=O)CCl)c1c(C)csc1C
InChI
InChI=1S/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3
IUPAC
2-chloro-N-(2,4-dimethylthiophen-3-yl)-N-(1-methoxypropan-2-yl)acetamide
Dimethoate
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C5 H12 N O3 P S2
Molecular Weight
229.26
Accurate Mass
228.9996
SMILES
CNC(=O)CSP(=S)(OC)OC
InChI
InChI=1S/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)
IUPAC
2-dimethoxyphosphinothioylsulfanyl-N-methylacetamide
Dimethylvinphos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H10 Cl3 O4 P
Molecular Weight
331.5168
Accurate Mass
329.9382
SMILES
COP(=O)(OC)OC(=CCl)c1ccc(Cl)cc1Cl
InChI
InChI=1S/C10H10Cl3O4P/c1-15-18(14,16-2)17-10(6-11)8-4-3-7(12)5-9(8)13/h3-6H,1-2H3
IUPAC
[2-chloro-1-(2,4-dichlorophenyl)ethenyl] dimethyl phosphate
Dimoxystrobin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C19 H22 N2 O3
Molecular Weight
326.39
Accurate Mass
326.163
SMILES
CNC(=O)\C(=N\OC)\c1ccccc1COc2cc(C)ccc2C
InChI
InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18+
IUPAC
(2E)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide
Dioxathion
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H26 O6 P2 S4
Molecular Weight
456.54
Accurate Mass
456.0087
SMILES
CCOP(=S)(OCC)SC1OCCOC1SP(=S)(OCC)OCC
InChI
InChI=1S/C12H26O6P2S4/c1-5-15-19(21,16-6-2)23-11-12(14-10-9-13-11)24-20(22,17-7-3)18-8-4/h11-12H,5-10H2,1-4H3
IUPAC
(3-diethoxyphosphinothioylsulfanyl-1,4-dioxan-2-yl)sulfanyl-diethoxy-sulfanylidene-?^{5}-phosphane
Ditalimfos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H14 N O4 P S
Molecular Weight
299.28
Accurate Mass
299.0381
SMILES
CCOP(=S)(OCC)N1C(=O)c2ccccc2C1=O
InChI
InChI=1S/C12H14NO4PS/c1-3-16-18(19,17-4-2)13-11(14)9-7-5-6-8-10(9)12(13)15/h5-8H,3-4H2,1-2H3
IUPAC
2-diethoxyphosphinothioylisoindole-1,3-dione
Doramectin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C50 H74 O14
Molecular Weight
899.11
Accurate Mass
898.5079
SMILES
CO[C@H]1C[C@H](O[C@H]2[C@H](C)O[C@H](C[C@@H]2OC)O[C@H]3[C@@H](C)\C=C\C=C\4/CO[C@@H]5[C@H](O)C(=C[C@@H](C(=O)O[C@H]6C[C@@H](C\C=C\3/C)O[C@@]7(C6)O[C@H](C8CCCCC8)[C@@H](C)C=C7)[C@]45O)C)O[C@@H](C)[C@@H]1O
InChI
InChI=1S/C50H74O14/c1-27-13-12-16-34-26-57-47-42(51)30(4)21-37(50(34,47)54)48(53)60-36-22-35(63-49(25-36)20-19-29(3)45(64-49)33-14-10-9-11-15-33)18-17-28(2)44(27)61-41-24-39(56-8)46(32(6)59-41)62-40-23-38(55-7)43(52)31(5)58-40/h12-13,16-17,19-21,27,29,31-33,35-47,51-52,54H,9-11,14-15,18,22-26H2,1-8H3/b13-12+,28-17+,34-16+/t27-,29-,31-,32-,35+,36-,37-,38-,39-,40-,41-,42+,43-,44-,45-,46-,47+,49+,50+/m0/s1
IUPAC
(1'R,2R,3S,4'S,6S,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'R,24'S)-2-cyclohexyl-21',24'-dihydroxy-12'-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one
E-Diniconazole
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H17 Cl2 N3 O
Molecular Weight
326.22
Accurate Mass
325.0749
SMILES
CC(C)(C)C(O)\C(=C/c1ccc(Cl)cc1Cl)\n2cncn2
InChI
InChI=1S/C15H17Cl2N3O/c1-15(2,3)14(21)13(20-9-18-8-19-20)6-10-4-5-11(16)7-12(10)17/h4-9,14,21H,1-3H3/b13-6+
IUPAC
(E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol
Empenthrin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H26 O2
Molecular Weight
274.40
Accurate Mass
274.1933
SMILES
CC\C=C(/C)\C(OC(=O)C1C(C=C(C)C)C1(C)C)C#C
InChI
InChI=1S/C18H26O2/c1-8-10-13(5)15(9-2)20-17(19)16-14(11-12(3)4)18(16,6)7/h2,10-11,14-16H,8H2,1,3-7H3/b13-10+
IUPAC
[(E)-4-methylhept-4-en-1-yn-3-yl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Eprinomectin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C50 H75 N O14 . C49 H73 N O14
Molecular Weight
1814.23
Accurate Mass
1813.0219
SMILES
CC[C@H](C)[C@H]1O[C@@]2(C[C@@H]3C[C@@H](C\C=C(/C)\[C@@H](O[C@H]4C[C@H](OC)[C@@H](O[C@H]5C[C@H](OC)[C@H](NC(=O)C)[C@H](C)O5)[C@H](C)O4)[C@@H](C)\C=C\C=C\6/CO[C@@H]7[C@H](O)C(=C[C@@H](C(=O)O3)[C@]67O)C)O2)C=C[C@@H]1C.CO[C@H]8C[C@H](O[C@H]9[C@H](C)O[C@H](C[C@@H]9OC)O[C@H]%10[C@@H](C)\C=C\C=C\%11/CO[C@@H]%12[C@H](O)C(=C[C@@H](C(=O)O[C@H]%13C[C@@H](C\C=C\%10/C)O[C@@]%14(C%13)O[C@H](C(C)C)[C@@H](C)C=C%14)[C@]%11%12O)C)O[C@@H](C)[C@H]8NC(=O)C
InChI
InChI=1S/C50H75NO14.C49H73NO14/c1-12-26(2)45-29(5)18-19-49(65-45)24-36-21-35(64-49)17-16-28(4)44(27(3)14-13-15-34-25-58-47-43(53)30(6)20-37(48(54)61-36)50(34,47)55)62-41-23-39(57-11)46(32(8)60-41)63-40-22-38(56-10)42(31(7)59-40)51-33(9)52;1-25(2)43-28(5)17-18-48(64-43)23-35-20-34(63-48)16-15-27(4)44(26(3)13-12-14-33-24-57-46-42(52)29(6)19-36(47(53)60-35)49(33,46)54)61-40-22-38(56-11)45(31(8)59-40)62-39-21-37(55-10)41(30(7)58-39)50-32(9)51/h13-16,18-20,26-27,29,31-32,35-47,53,55H,12,17,21-25H2,1-11H3,(H,51,52);12-15,17-19,25-26,28,30-31,34-46,52,54H,16,20-24H2,1-11H3,(H,50,51)/b14-13+,28-16+,34-15+;13-12+,27-15+,33-14+/t26-,27-,29-,31-,32-,35+,36-,37-,38-,39-,40-,41-,42+,43+,44-,45+,46-,47+,49+,50+;26-,28-,30-,31-,34+,35-,36-,37-,38-,39-,40-,41+,42+,43+,44-,45-,46+,48+,49+/m00/s1
Fenbuconazole
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C19 H17 Cl N4
Molecular Weight
336.82
Accurate Mass
336.1142
SMILES
Clc1ccc(CCC(Cn2cncn2)(C#N)c3ccccc3)cc1
InChI
InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2
IUPAC
4-(4-chlorophenyl)-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile
Fenchlorazol-ethyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H8 Cl5 N3 O2
Molecular Weight
403.48
Accurate Mass
400.9059
SMILES
CCOC(=O)c1nc(n(n1)c2ccc(Cl)cc2Cl)C(Cl)(Cl)Cl
InChI
InChI=1S/C12H8Cl5N3O2/c1-2-22-10(21)9-18-11(12(15,16)17)20(19-9)8-4-3-6(13)5-7(8)14/h3-5H,2H2,1H3
IUPAC
ethyl 1-(2,4-dichlorophenyl)-5-(trichloromethyl)-1,2,4-triazole-3-carboxylate
Fenfuram
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H11 N O2
Molecular Weight
201.22
Accurate Mass
201.079
SMILES
Cc1occc1C(=O)Nc2ccccc2
InChI
InChI=1S/C12H11NO2/c1-9-11(7-8-15-9)12(14)13-10-5-3-2-4-6-10/h2-8H,1H3,(H,13,14)
IUPAC
2-methyl-N-phenylfuran-3-carboxamide
Fenhexamid
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H17 Cl2 N O2
Molecular Weight
302.20
Accurate Mass
301.0636
SMILES
CC1(CCCCC1)C(=O)Nc2ccc(O)c(Cl)c2Cl
InChI
InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)
IUPAC
N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide
Fenoxaprop
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C16 H12 Cl N O5
Molecular Weight
333.72
Accurate Mass
333.0404
SMILES
CC(Oc1ccc(Oc2oc3cc(Cl)ccc3n2)cc1)C(=O)O
InChI
InChI=1S/C16H12ClNO5/c1-9(15(19)20)21-11-3-5-12(6-4-11)22-16-18-13-7-2-10(17)8-14(13)23-16/h2-9H,1H3,(H,19,20)
IUPAC
2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoic acid
Fensulfothion-oxon
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H17 O5 P S
Molecular Weight
292.29
Accurate Mass
292.0534
SMILES
CCOP(=O)(OCC)Oc1ccc(cc1)S(=O)C
InChI
InChI=1S/C11H17O5PS/c1-4-14-17(12,15-5-2)16-10-6-8-11(9-7-10)18(3)13/h6-9H,4-5H2,1-3H3
IUPAC
diethyl (4-methylsulfinylphenyl) phosphate
Fensulfothion-oxon-sulfone
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H17 O6 P S
Molecular Weight
308.29
Accurate Mass
308.0483
SMILES
CCOP(=O)(OCC)Oc1ccc(cc1)S(=O)(=O)C
InChI
InChI=1S/C11H17O6PS/c1-4-15-18(12,16-5-2)17-10-6-8-11(9-7-10)19(3,13)14/h6-9H,4-5H2,1-3H3
IUPAC
diethyl (4-methylsulfonylphenyl) phosphate
Fensulfothion-sulfone
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H17 O5 P S2
Molecular Weight
324.35
Accurate Mass
324.0255
SMILES
CCOP(=S)(OCC)Oc1ccc(cc1)S(=O)(=O)C
InChI
InChI=1S/C11H17O5PS2/c1-4-14-17(18,15-5-2)16-10-6-8-11(9-7-10)19(3,12)13/h6-9H,4-5H2,1-3H3
IUPAC
diethoxy-(4-methylsulfonylphenoxy)-sulfanylidene-?^{5}-phosphane
Fenthion-sulfoxide
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H15 O4 P S2
Molecular Weight
294.33
Accurate Mass
294.0149
SMILES
COP(=S)(OC)Oc1ccc(c(C)c1)S(=O)C
InChI
InChI=1S/C10H15O4PS2/c1-8-7-9(5-6-10(8)17(4)11)14-15(16,12-2)13-3/h5-7H,1-4H3
IUPAC
dimethoxy-(3-methyl-4-methylsulfinylphenoxy)-sulfanylidene-?^{5}-phosphane
Fluacrypyrim
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C20 H21 F3 N2 O5
Molecular Weight
426.39
Accurate Mass
426.1403
SMILES
CO\C=C(\C(=O)OC)/c1ccccc1COc2cc(nc(OC(C)C)n2)C(F)(F)F
InChI
InChI=1S/C20H21F3N2O5/c1-12(2)30-19-24-16(20(21,22)23)9-17(25-19)29-10-13-7-5-6-8-14(13)15(11-27-3)18(26)28-4/h5-9,11-12H,10H2,1-4H3/b15-11+
IUPAC
methyl (E)-3-methoxy-2-[2-[[2-propan-2-yloxy-6-(trifluoromethyl)pyrimidin-4-yl]oxymethyl]phenyl]prop-2-enoate
Fluazinam
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C13 H4 Cl2 F6 N4 O4
Molecular Weight
465.09
Accurate Mass
463.9514
SMILES
[O-][N+](=O)c1cc(c(Cl)c(c1Nc2ncc(cc2Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F
InChI
InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)
IUPAC
3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine
Flucythrinate
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C26 H23 F2 N O4
Molecular Weight
451.46
Accurate Mass
451.1595
SMILES
CC(C)C(C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1)c3ccc(OC(F)F)cc3
InChI
InChI=1S/C26H23F2NO4/c1-17(2)24(18-11-13-21(14-12-18)32-26(27)28)25(30)33-23(16-29)19-7-6-10-22(15-19)31-20-8-4-3-5-9-20/h3-15,17,23-24,26H,1-2H3
IUPAC
[cyano-(3-phenoxyphenyl)methyl] 2-[4-(difluoromethoxy)phenyl]-3-methylbutanoate
Fluotrimazole
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C22 H16 F3 N3
Molecular Weight
379.38
Accurate Mass
379.1296
SMILES
FC(F)(F)c1cccc(c1)C(c2ccccc2)(c3ccccc3)n4cncn4
InChI
InChI=1S/C22H16F3N3/c23-22(24,25)20-13-7-12-19(14-20)21(28-16-26-15-27-28,17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-16H
IUPAC
1-[diphenyl-[3-(trifluoromethyl)phenyl]methyl]-1,2,4-triazole
Flurenol-butyl ester
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H18 O3
Molecular Weight
282.33
Accurate Mass
282.1256
SMILES
CCCCOC(=O)C1(O)c2ccccc2c3ccccc13
InChI
InChI=1S/C18H18O3/c1-2-3-12-21-17(19)18(20)15-10-6-4-8-13(15)14-9-5-7-11-16(14)18/h4-11,20H,2-3,12H2,1H3
IUPAC
butyl 9-hydroxyfluorene-9-carboxylate
Flurenol-methyl ester
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H12 O3
Molecular Weight
240.25
Accurate Mass
240.0786
SMILES
COC(=O)C1(O)c2ccccc2c3ccccc13
InChI
InChI=1S/C15H12O3/c1-18-14(16)15(17)12-8-4-2-6-10(12)11-7-3-5-9-13(11)15/h2-9,17H,1H3
IUPAC
methyl 9-hydroxyfluorene-9-carboxylate
Fluroxypyr-1-methylheptylester
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H21 Cl2 F N2 O3
Molecular Weight
367.24
Accurate Mass
366.0913
SMILES
CCCCCCC(C)OC(=O)COc1nc(F)c(Cl)c(N)c1Cl
InChI
InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)
IUPAC
octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate
Flurprimidol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H15 F3 N2 O2
Molecular Weight
312.29
Accurate Mass
312.1086
SMILES
CC(C)C(O)(c1ccc(OC(F)(F)F)cc1)c2cncnc2
InChI
InChI=1S/C15H15F3N2O2/c1-10(2)14(21,12-7-19-9-20-8-12)11-3-5-13(6-4-11)22-15(16,17)18/h3-10,21H,1-2H3
IUPAC
2-methyl-1-pyrimidin-5-yl-1-[4-(trifluoromethoxy)phenyl]propan-1-ol
Flutriafol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C16 H13 F2 N3 O
Molecular Weight
301.29
Accurate Mass
301.1027
SMILES
OC(Cn1cncn1)(c2ccc(F)cc2)c3ccccc3F
InChI
InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2
IUPAC
1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)ethanol
Fosthiazate
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C9 H18 N O3 P S2
Molecular Weight
283.35
Accurate Mass
283.0466
SMILES
CCOP(=O)(SC(C)CC)N1CCSC1=O
InChI
InChI=1S/C9H18NO3PS2/c1-4-8(3)16-14(12,13-5-2)10-6-7-15-9(10)11/h8H,4-7H2,1-3H3
IUPAC
3-[butan-2-ylsulfanyl(ethoxy)phosphoryl]-1,3-thiazolidin-2-one
Haloxyfop-ethoxyethyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C19 H19 Cl F3 N O5
Molecular Weight
433.81
Accurate Mass
433.0904
SMILES
CCOCCOC(=O)C(C)Oc1ccc(Oc2ncc(cc2Cl)C(F)(F)F)cc1
InChI
InChI=1S/C19H19ClF3NO5/c1-3-26-8-9-27-18(25)12(2)28-14-4-6-15(7-5-14)29-17-16(20)10-13(11-24-17)19(21,22)23/h4-7,10-12H,3,8-9H2,1-2H3
IUPAC
2-ethoxyethyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate
Hexaflumuron
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C16 H8 Cl2 F6 N2 O3
Molecular Weight
461.14
Accurate Mass
459.9816
SMILES
FC(F)C(F)(F)Oc1c(Cl)cc(NC(=O)NC(=O)c2c(F)cccc2F)cc1Cl
InChI
InChI=1S/C16H8Cl2F6N2O3/c17-7-4-6(5-8(18)12(7)29-16(23,24)14(21)22)25-15(28)26-13(27)11-9(19)2-1-3-10(11)20/h1-5,14H,(H2,25,26,27,28)
IUPAC
N-[[3,5-dichloro-4-(1,1,2,2-tetrafluoroethoxy)phenyl]carbamoyl]-2,6-difluorobenzamide
Ipconazole
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H24 Cl N3 O
Molecular Weight
333.86
Accurate Mass
333.1608
SMILES
CC(C)C1CCC(Cc2ccc(Cl)cc2)C1(O)Cn3cncn3
InChI
InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3
IUPAC
2-[(4-chlorophenyl)methyl]-5-propan-2-yl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol
Isazofos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C9 H17 Cl N3 O3 P S
Molecular Weight
313.74
Accurate Mass
313.0417
SMILES
CCOP(=S)(OCC)Oc1nc(Cl)n(n1)C(C)C
InChI
InChI=1S/C9H17ClN3O3PS/c1-5-14-17(18,15-6-2)16-9-11-8(10)13(12-9)7(3)4/h7H,5-6H2,1-4H3
IUPAC
(5-chloro-1-propan-2-yl-1,2,4-triazol-3-yl)oxy-diethoxy-sulfanylidene-?^{5}-phosphane
Isocarbofos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H16 N O4 P S
Molecular Weight
289.29
Accurate Mass
289.0538
SMILES
COP(=S)(N)Oc1ccccc1C(=O)OC(C)C
InChI
InChI=1S/C11H16NO4PS/c1-8(2)15-11(13)9-6-4-5-7-10(9)16-17(12,18)14-3/h4-8H,1-3H3,(H2,12,18)
IUPAC
propan-2-yl 2-[amino(methoxy)phosphinothioyl]oxybenzoate
Isoprothiolane
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H18 O4 S2
Molecular Weight
290.40
Accurate Mass
290.0647
SMILES
CC(C)OC(=O)C(=C1SCCS1)C(=O)OC(C)C
InChI
InChI=1S/C12H18O4S2/c1-7(2)15-10(13)9(11(14)16-8(3)4)12-17-5-6-18-12/h7-8H,5-6H2,1-4H3
IUPAC
dipropan-2-yl 2-(1,3-dithiolan-2-ylidene)propanedioate
Isoxadifen-ethyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H17 N O3
Molecular Weight
295.33
Accurate Mass
295.1208
SMILES
CCOC(=O)C1=NOC(C1)(c2ccccc2)c3ccccc3
InChI
InChI=1S/C18H17NO3/c1-2-21-17(20)16-13-18(22-19-16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3
IUPAC
ethyl 5,5-diphenyl-4H-1,2-oxazole-3-carboxylate
Ivermectin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C48 H74 O14 . C47 H72 O14
Molecular Weight
1736.16
Accurate Mass
1735.0001
SMILES
CC[C@H](C)[C@H]1O[C@]2(CC[C@@H]1C)C[C@@H]3C[C@@H](C\C=C(/C)\[C@@H](O[C@H]4C[C@H](OC)[C@@H](O[C@H]5C[C@H](OC)[C@@H](O)[C@H](C)O5)[C@H](C)O4)[C@@H](C)\C=C\C=C\6/CO[C@@H]7[C@H](O)C(=C[C@@H](C(=O)O3)[C@]67O)C)O2.CO[C@H]8C[C@H](O[C@H]9[C@H](C)O[C@H](C[C@@H]9OC)O[C@H]%10[C@@H](C)\C=C\C=C\%11/CO[C@@H]%12[C@H](O)C(=C[C@@H](C(=O)O[C@H]%13C[C@@H](C\C=C\%10/C)O[C@@]%14(CC[C@H](C)[C@H](O%14)C(C)C)C%13)[C@]%11%12O)C)O[C@@H](C)[C@@H]8O
InChI
InChI=1S/C48H74O14.C47H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38;1-24(2)41-27(5)16-17-46(61-41)22-33-19-32(60-46)15-14-26(4)42(25(3)12-11-13-31-23-54-44-39(48)28(6)18-34(45(50)57-33)47(31,44)51)58-38-21-36(53-10)43(30(8)56-38)59-37-20-35(52-9)40(49)29(7)55-37/h12-15,19,25-26,28,30-31,33-45,49-50,52H,11,16-18,20-24H2,1-10H3;11-14,18,24-25,27,29-30,32-44,48-49,51H,15-17,19-23H2,1-10H3/b13-12+,27-15+,32-14+;12-11+,26-14+,31-13+/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+;25-,27-,29-,30-,32+,33-,34-,35-,36-,37-,38-,39+,40-,41+,42-,43-,44+,46+,47+/m00/s1
IUPAC
Ivermectin
Lufenuron
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C17 H8 Cl2 F8 N2 O3
Molecular Weight
511.15
Accurate Mass
509.9784
SMILES
FC(C(F)(F)F)C(F)(F)Oc1cc(Cl)c(NC(=O)NC(=O)c2c(F)cccc2F)cc1Cl
InChI
InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)
IUPAC
N-[[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl]-2,6-difluorobenzamide
Mefenpyr-diethyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C16 H18 Cl2 N2 O4
Molecular Weight
373.23
Accurate Mass
372.0644
SMILES
CCOC(=O)C1=NN(c2ccc(Cl)cc2Cl)C(C)(C1)C(=O)OCC
InChI
InChI=1S/C16H18Cl2N2O4/c1-4-23-14(21)12-9-16(3,15(22)24-5-2)20(19-12)13-7-6-10(17)8-11(13)18/h6-8H,4-5,9H2,1-3H3
IUPAC
diethyl 1-(2,4-dichlorophenyl)-5-methyl-4H-pyrazole-3,5-dicarboxylate
Metrafenone
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C19 H21 Br O5
Molecular Weight
409.27
Accurate Mass
408.0572
SMILES
COc1cc(C)c(C(=O)c2c(C)c(Br)ccc2OC)c(OC)c1OC
InChI
InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3
IUPAC
(3-bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone
Neburon
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H16 Cl2 N2 O
Molecular Weight
275.17
Accurate Mass
274.064
SMILES
CCCCN(C)C(=O)Nc1ccc(Cl)c(Cl)c1
InChI
InChI=1S/C12H16Cl2N2O/c1-3-4-7-16(2)12(17)15-9-5-6-10(13)11(14)8-9/h5-6,8H,3-4,7H2,1-2H3,(H,15,17)
IUPAC
1-butyl-3-(3,4-dichlorophenyl)-1-methylurea
Oryzalin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H18 N4 O6 S
Molecular Weight
346.36
Accurate Mass
346.0947
SMILES
CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])S(=O)(=O)N)[N+](=O)[O-]
InChI
InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)
IUPAC
4-(dipropylamino)-3,5-dinitrobenzenesulfonamide
Oxamyl-oxime
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C5 H10 N2 O2 S
Molecular Weight
162.21
Accurate Mass
162.0463
SMILES
CS\C(=N\O)\C(=O)N(C)C
InChI
InChI=1S/C5H10N2O2S/c1-7(2)5(8)4(6-9)10-3/h9H,1-3H3/b6-4+
IUPAC
methyl (1E)-2-(dimethylamino)-N-hydroxy-2-oxoethanimidothioate
Pendimethalin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C13 H19 N3 O4
Molecular Weight
281.31
Accurate Mass
281.1376
SMILES
CCC(CC)Nc1c(cc(C)c(C)c1[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C13H19N3O4/c1-5-10(6-2)14-12-11(15(17)18)7-8(3)9(4)13(12)16(19)20/h7,10,14H,5-6H2,1-4H3
IUPAC
3,4-dimethyl-2,6-dinitro-N-pentan-3-ylaniline
Phenmedipham
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C16 H16 N2 O4
Molecular Weight
300.31
Accurate Mass
300.111
SMILES
COC(=O)Nc1cccc(OC(=O)Nc2cccc(C)c2)c1
InChI
InChI=1S/C16H16N2O4/c1-11-5-3-6-12(9-11)18-16(20)22-14-8-4-7-13(10-14)17-15(19)21-2/h3-10H,1-2H3,(H,17,19)(H,18,20)
IUPAC
[3-(methoxycarbonylamino)phenyl] N-(3-methylphenyl)carbamate
Phorate Oxon
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H17 O3 P S2
Molecular Weight
244.31
Accurate Mass
244.0357
SMILES
CCOP(=O)(OCC)SCSCC
InChI
InChI=1S/C7H17O3PS2/c1-4-9-11(8,10-5-2)13-7-12-6-3/h4-7H2,1-3H3
IUPAC
1-[ethoxy(ethylsulfanylmethylsulfanyl)phosphoryl]oxyethane
Picolinafen
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C19 H12 F4 N2 O2
Molecular Weight
376.30
Accurate Mass
376.0835
SMILES
Fc1ccc(NC(=O)c2cccc(Oc3cccc(c3)C(F)(F)F)n2)cc1
InChI
InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)
IUPAC
N-(4-fluorophenyl)-6-[3-(trifluoromethyl)phenoxy]pyridine-2-carboxamide
Picoxystrobin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H16 F3 N O4
Molecular Weight
367.32
Accurate Mass
367.1031
SMILES
CO\C=C(\C(=O)OC)/c1ccccc1COc2cccc(n2)C(F)(F)F
InChI
InChI=1S/C18H16F3NO4/c1-24-11-14(17(23)25-2)13-7-4-3-6-12(13)10-26-16-9-5-8-15(22-16)18(19,20)21/h3-9,11H,10H2,1-2H3/b14-11+
IUPAC
methyl (E)-3-methoxy-2-[2-[[6-(trifluoromethyl)pyridin-2-yl]oxymethyl]phenyl]prop-2-enoate
Prallethrin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C19 H24 O3
Molecular Weight
300.39
Accurate Mass
300.1725
SMILES
CC(=CC1C(C(=O)OC2CC(=O)C(=C2C)CC#C)C1(C)C)C
InChI
InChI=1S/C19H24O3/c1-7-8-13-12(4)16(10-15(13)20)22-18(21)17-14(9-11(2)3)19(17,5)6/h1,9,14,16-17H,8,10H2,2-6H3
IUPAC
(2-methyl-4-oxo-3-prop-2-ynylcyclopent-2-en-1-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Pretilachlor
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C17 H26 Cl N O2
Molecular Weight
311.85
Accurate Mass
311.1652
SMILES
CCCOCCN(C(=O)CCl)c1c(CC)cccc1CC
InChI
InChI=1S/C17H26ClNO2/c1-4-11-21-12-10-19(16(20)13-18)17-14(5-2)8-7-9-15(17)6-3/h7-9H,4-6,10-13H2,1-3H3
IUPAC
2-chloro-N-(2,6-diethylphenyl)-N-(2-propoxyethyl)acetamide
Propaphos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C13 H21 O4 P S
Molecular Weight
304.34
Accurate Mass
304.0898
SMILES
CCCOP(=O)(OCCC)Oc1ccc(SC)cc1
InChI
InChI=1S/C13H21O4PS/c1-4-10-15-18(14,16-11-5-2)17-12-6-8-13(19-3)9-7-12/h6-9H,4-5,10-11H2,1-3H3
IUPAC
(4-methylsulfanylphenyl) dipropyl phosphate
Propoxur
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H15 N O3
Molecular Weight
209.24
Accurate Mass
209.1052
SMILES
CNC(=O)Oc1ccccc1OC(C)C
InChI
InChI=1S/C11H15NO3/c1-8(2)14-9-6-4-5-7-10(9)15-11(13)12-3/h4-8H,1-3H3,(H,12,13)
IUPAC
(2-propan-2-yloxyphenyl) N-methylcarbamate
Proquinazid
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H17 I N2 O2
Molecular Weight
372.20
Accurate Mass
372.0335
SMILES
CCCOC1=Nc2ccc(I)cc2C(=O)N1CCC
InChI
InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3
IUPAC
6-iodo-2-propoxy-3-propylquinazolin-4-one
Prothioconazole-desthio
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H15 Cl2 N3 O
Molecular Weight
312.19
Accurate Mass
311.0592
SMILES
OC(Cc1ccccc1Cl)(Cn2cncn2)C3(Cl)CC3
InChI
InChI=1S/C14H15Cl2N3O/c15-12-4-2-1-3-11(12)7-14(20,13(16)5-6-13)8-19-10-17-9-18-19/h1-4,9-10,20H,5-8H2
IUPAC
2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-ol
Pyraflufen-ethyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H13 Cl2 F3 N2 O4
Molecular Weight
413.18
Accurate Mass
412.0204
SMILES
CCOC(=O)COc1cc(c(F)cc1Cl)c2nn(C)c(OC(F)F)c2Cl
InChI
InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3
IUPAC
ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate
Pyridalyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H14 Cl4 F3 N O3
Molecular Weight
491.12
Accurate Mass
488.968
SMILES
FC(F)(F)c1ccc(OCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)nc1
InChI
InChI=1S/C18H14Cl4F3NO3/c19-13-8-12(27-7-4-15(21)22)9-14(20)17(13)29-6-1-5-28-16-3-2-11(10-26-16)18(23,24)25/h2-4,8-10H,1,5-7H2
IUPAC
2-[3-[2,6-dichloro-4-(3,3-dichloroprop-2-enoxy)phenoxy]propoxy]-5-(trifluoromethyl)pyridine
Spirotetramat
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C21 H27 N O5
Molecular Weight
373.44
Accurate Mass
373.1889
SMILES
CCOC(=O)OC1=C(C(=O)N[C@@]12CC[C@@H](CC2)OC)c3cc(C)ccc3C
InChI
InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)/t15-,21+
IUPAC
[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl] ethyl carbonate
Spirotetramat-mono-hydroxy
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H25 N O3
Molecular Weight
303.40
Accurate Mass
303.1834
SMILES
CO[C@@H]1CC[C@@]2(CC1)NC(=O)C(C2O)c3cc(C)ccc3C
InChI
InChI=1S/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)/t13-,15?,16?,18+
IUPAC
3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one
Sulfentrazone
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H10 Cl2 F2 N4 O3 S
Molecular Weight
387.19
Accurate Mass
385.9819
SMILES
CC1=NN(C(=O)N1C(F)F)c2cc(NS(=O)(=O)C)c(Cl)cc2Cl
InChI
InChI=1S/C11H10Cl2F2N4O3S/c1-5-16-19(11(20)18(5)10(14)15)9-4-8(17-23(2,21)22)6(12)3-7(9)13/h3-4,10,17H,1-2H3
IUPAC
N-[2,4-dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]phenyl]methanesulfonamide
Tebutam
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H23 N O
Molecular Weight
233.35
Accurate Mass
233.178
SMILES
CC(C)N(Cc1ccccc1)C(=O)C(C)(C)C
InChI
InChI=1S/C15H23NO/c1-12(2)16(14(17)15(3,4)5)11-13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3
IUPAC
N-benzyl-2,2-dimethyl-N-propan-2-ylpropanamide
Teflubenzuron
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H6 Cl2 F4 N2 O2
Molecular Weight
381.11
Accurate Mass
379.9742
SMILES
Fc1cccc(F)c1C(=O)NC(=O)Nc2cc(Cl)c(F)c(Cl)c2F
InChI
InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)
IUPAC
N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide
Thiofanox-sulfone
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C9 H18 N2 O4 S
Molecular Weight
250.32
Accurate Mass
250.0987
SMILES
CNC(=O)ON=C(CS(=O)(=O)C)C(C)(C)C
InChI
InChI=1S/C9H18N2O4S/c1-9(2,3)7(6-16(5,13)14)11-15-8(12)10-4/h6H2,1-5H3,(H,10,12)
IUPAC
[(3,3-dimethyl-1-methylsulfonylbutan-2-ylidene)amino] N-methylcarbamate
Thiofanox-sulfoxide
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C9 H18 N2 O3 S
Molecular Weight
234.32
Accurate Mass
234.1038
SMILES
CNC(=O)ON=C(CS(=O)C)C(C)(C)C
InChI
InChI=1S/C9H18N2O3S/c1-9(2,3)7(6-15(5)13)11-14-8(12)10-4/h6H2,1-5H3,(H,10,12)
IUPAC
[(3,3-dimethyl-1-methylsulfinylbutan-2-ylidene)amino] N-methylcarbamate
Tolfenpyrad
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C21 H22 Cl N3 O2
Molecular Weight
383.87
Accurate Mass
383.1401
SMILES
CCc1nn(C)c(C(=O)NCc2ccc(Oc3ccc(C)cc3)cc2)c1Cl
InChI
InChI=1S/C21H22ClN3O2/c1-4-18-19(22)20(25(3)24-18)21(26)23-13-15-7-11-17(12-8-15)27-16-9-5-14(2)6-10-16/h5-12H,4,13H2,1-3H3,(H,23,26)
IUPAC
4-chloro-5-ethyl-2-methyl-N-[[4-(4-methylphenoxy)phenyl]methyl]pyrazole-3-carboxamide
Triallate
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H16 Cl3 N O S
Molecular Weight
304.66
Accurate Mass
303.0018
SMILES
CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl
InChI
InChI=1S/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3
IUPAC
S-(2,3,3-trichloroprop-2-enyl) N,N-di(propan-2-yl)carbamothioate
Triforine
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H14 Cl6 N4 O2
Molecular Weight
434.96
Accurate Mass
431.9248
SMILES
ClC(Cl)(Cl)C(NC=O)N1CCN(CC1)C(NC=O)C(Cl)(Cl)Cl
InChI
InChI=1S/C10H14Cl6N4O2/c11-9(12,13)7(17-5-21)19-1-2-20(4-3-19)8(18-6-22)10(14,15)16/h5-8H,1-4H2,(H,17,21)(H,18,22)
IUPAC
N-[2,2,2-trichloro-1-[4-(2,2,2-trichloro-1-formamidoethyl)piperazin-1-yl]ethyl]formamide
Triticonazole
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C17 H20 Cl N3 O
Molecular Weight
317.81
Accurate Mass
317.1295
SMILES
CC1(C)CC\C(=C/c2ccc(Cl)cc2)\C1(O)Cn3cncn3
InChI
InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+
IUPAC
(5E)-5-[(4-chlorophenyl)methylidene]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol
Product Data
Storage Temperature
-18°C
Shipping Temperature
+20°C
Country of Origin
UNITED STATES
Product Format
Mixture
Solvent
Acetonitrile
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{{ errors.first('requestQuoteForm.shippingLine1') }}
{{ errors.first('requestQuoteForm.shippingCountry') }}
{{ errors.first('requestQuoteForm.shippingState') }}
{{ errors.first('requestQuoteForm.shippingCity') }}
{{ errors.first('requestQuoteForm.shippingPostCode') }}
{{ errors.first('requestQuoteForm.billingCompanyName') }}
{{ errors.first('requestQuoteForm.billingLine1') }}
{{ errors.first('requestQuoteForm.billingCountry') }}
{{ errors.first('requestQuoteForm.billingState') }}
{{ errors.first('requestQuoteForm.billingCity') }}
{{ errors.first('requestQuoteForm.billingPostCode') }}
{{ errors.first('requestQuoteForm.deliveryCountry') }}
{{ errors.first('requestQuoteForm.packSize') }}
{{ errors.first('requestQuoteForm.quantity') }}