GB 3838-2002 SVOC Mixture 500 µg/mL in Toluene
Product Code
DRE-A30000016TO
CAS Number
24 AnalytesProduct Format
Mixture
Solvent
Toluene
Product Categories
Product Type
Native/ParentShare product
- Product Name: GB 3838-2002 SVOC Mixture 500 µg/mL in Toluene
- Product Code: DRE-A30000016TO
- Brand: Dr. Ehrenstorfer
Documentation
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Product Information
Analyte Data
Analyte Name
Measured Value
CAS Number
Molecular Structure
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CAS Number
Alternate CAS Number
Unlabelled CAS Number
Molecular Formula
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Molecular Weight
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Accurate Mass
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Melting Point
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Appearance/Form
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SMILES
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InChI
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IUPAC
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1,2,3,4-Tetrachlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H2 Cl4
Molecular Weight
215.89
Accurate Mass
213.8911
SMILES
Clc1ccc(Cl)c(Cl)c1Cl
InChI
InChI=1S/C6H2Cl4/c7-3-1-2-4(8)6(10)5(3)9/h1-2H
IUPAC
1,2,3,4-tetrachlorobenzene
1,2,3,5-Tetrachlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H2 Cl4
Molecular Weight
215.89
Accurate Mass
213.8911
SMILES
Clc1cc(Cl)c(Cl)c(Cl)c1
InChI
InChI=1S/C6H2Cl4/c7-3-1-4(8)6(10)5(9)2-3/h1-2H
IUPAC
1,2,3,5-tetrachlorobenzene
1,2,3-Trichlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H3 Cl3
Molecular Weight
181.45
Accurate Mass
179.93
SMILES
Clc1cccc(Cl)c1Cl
InChI
InChI=1S/C6H3Cl3/c7-4-2-1-3-5(8)6(4)9/h1-3H
IUPAC
1,2,3-trichlorobenzene
1,2,4,5-Tetrachlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H2 Cl4
Molecular Weight
215.89
Accurate Mass
213.8911
SMILES
Clc1cc(Cl)c(Cl)cc1Cl
InChI
InChI=1S/C6H2Cl4/c7-3-1-4(8)6(10)2-5(3)9/h1-2H
IUPAC
1,2,4,5-tetrachlorobenzene
1,2,4-Trichlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H3 Cl3
Molecular Weight
181.45
Accurate Mass
179.93
SMILES
Clc1ccc(Cl)c(Cl)c1
InChI
InChI=1S/C6H3Cl3/c7-4-1-2-5(8)6(9)3-4/h1-3H
IUPAC
1,2,4-trichlorobenzene
1,2-Dinitrobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 N2 O4
Molecular Weight
168.11
Accurate Mass
168.0171
SMILES
[O-][N+](=O)c1ccccc1[N+](=O)[O-]
InChI
InChI=1S/C6H4N2O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H
IUPAC
1,2-dinitrobenzene
1,3,5-Trichlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H3 Cl3
Molecular Weight
181.45
Accurate Mass
179.93
SMILES
Clc1cc(Cl)cc(Cl)c1
InChI
InChI=1S/C6H3Cl3/c7-4-1-5(8)3-6(9)2-4/h1-3H
IUPAC
1,3,5-trichlorobenzene
1,3-Dinitrobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 N2 O4
Molecular Weight
168.11
Accurate Mass
168.0171
SMILES
[O-][N+](=O)c1cccc(c1)[N+](=O)[O-]
InChI
InChI=1S/C6H4N2O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H
IUPAC
1,3-dinitrobenzene
1,4-Dinitrobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 N2 O4
Molecular Weight
168.11
Accurate Mass
168.0171
SMILES
[O-][N+](=O)c1ccc(cc1)[N+](=O)[O-]
InChI
InChI=1S/C6H4N2O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H
IUPAC
1,4-dinitrobenzene
1-Chloro-2,4-dinitrobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H3 Cl N2 O4
Molecular Weight
202.55
Accurate Mass
201.9781
SMILES
[O-][N+](=O)c1ccc(Cl)c(c1)[N+](=O)[O-]
InChI
InChI=1S/C6H3ClN2O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H
IUPAC
1-chloro-2,4-dinitrobenzene
1-Chloro-2-nitrobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl N O2
Molecular Weight
157.55
Accurate Mass
156.9931
SMILES
[O-][N+](=O)c1ccccc1Cl
InChI
InChI=1S/C6H4ClNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H
IUPAC
1-chloro-2-nitrobenzene
1-Chloro-3-nitrobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl N O2
Molecular Weight
157.55
Accurate Mass
156.9931
SMILES
[O-][N+](=O)c1cccc(Cl)c1
InChI
InChI=1S/C6H4ClNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H
IUPAC
1-chloro-3-nitrobenzene
1-Chloro-4-nitrobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl N O2
Molecular Weight
157.55
Accurate Mass
156.9931
SMILES
[O-][N+](=O)c1ccc(Cl)cc1
InChI
InChI=1S/C6H4ClNO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H
IUPAC
1-chloro-4-nitrobenzene
2,4,6-Trichlorophenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H3 Cl3 O
Molecular Weight
197.45
Accurate Mass
195.9249
SMILES
Oc1c(Cl)cc(Cl)cc1Cl
InChI
InChI=1S/C6H3Cl3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H
IUPAC
2,4,6-trichlorophenol
2,4,6-Trinitrotoluene (TNT)
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H5 N3 O6
Molecular Weight
227.13
Accurate Mass
227.0178
SMILES
Cc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C7H5N3O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3H,1H3
IUPAC
2-methyl-1,3,5-trinitrobenzene
2,4-Dichlorophenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl2 O
Molecular Weight
163.00
Accurate Mass
161.9639
SMILES
Oc1ccc(Cl)cc1Cl
InChI
InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H
IUPAC
2,4-dichlorophenol
2,4-Dinitrotoluene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H6 N2 O4
Molecular Weight
182.13
Accurate Mass
182.0328
SMILES
Cc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)4-7(5)9(12)13/h2-4H,1H3
IUPAC
1-methyl-2,4-dinitrobenzene
Aniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H7 N
Molecular Weight
93.13
Accurate Mass
93.0578
SMILES
Nc1ccccc1
InChI
InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2
IUPAC
aniline
Benzo[a]pyrene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C20 H12
Molecular Weight
252.31
Accurate Mass
252.0939
SMILES
c1ccc2c(c1)cc3ccc4cccc5ccc2c3c45
InChI
InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H
IUPAC
benzo[a]pyrene
Dibutyl phthalate
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C16 H22 O4
Molecular Weight
278.34
Accurate Mass
278.1518
SMILES
CCCCOC(=O)c1ccccc1C(=O)OCCCC
InChI
InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3
IUPAC
dibutyl benzene-1,2-dicarboxylate
Hexachlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 Cl6
Molecular Weight
284.78
Accurate Mass
281.8131
SMILES
Clc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
InChI
InChI=1S/C6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9
IUPAC
1,2,3,4,5,6-hexachlorobenzene
Nitrobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H5 N O2
Molecular Weight
123.11
Accurate Mass
123.032
SMILES
[O-][N+](=O)c1ccccc1
InChI
InChI=1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H
IUPAC
nitrobenzene
Pentachlorophenol
CAS Number
Alternate CAS Number
Unlabelled CAS Number
-
Molecular Formula
C6 H Cl5 O
Molecular Weight
266.34
Accurate Mass
263.847
SMILES
Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
InChI
InChI=1S/C6HCl5O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H
IUPAC
2,3,4,5,6-pentachlorophenol
Phthalic acid, bis-2-ethylhexyl ester
CAS Number
Alternate CAS Number
Unlabelled CAS Number
-
Molecular Formula
C24 H38 O4
Molecular Weight
390.56
Accurate Mass
390.277
SMILES
CCCCC(CC)COC(=O)c1ccccc1C(=O)OCC(CC)CCCC
InChI
InChI=1S/C24H38O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h11-12,15-16,19-20H,5-10,13-14,17-18H2,1-4H3
IUPAC
bis(2-ethylhexyl) benzene-1,2-dicarboxylate
Product Data
Storage Temperature
-18°C
Shipping Temperature
+20°C
Country of Origin
GERMANY
Product Format
Mixture
Solvent
Toluene
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