Per- and Polyfluoroalkyl Substances (PFAS) in Aqueous Film-Forming Foams (AFFF) Formulation I
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- Product Name: Per- and Polyfluoroalkyl Substances (PFAS) in Aqueous Film-Forming Foams (AFFF) Formulation I
- 产品代码 NIST-8690
- 品牌: National Institute of Standards and Technology
产品信息
分析物数据
分析物名称
Measured Value
CAS登记号
分子结构
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N-[3-(Dimethylamino)propyl]perfluoro-1-hexanesulfonamide
(9.12) µg/g
N-[3-(perfluoro-1-hexanesulfonamido)propan-1-yl]-N,N,N-trimethylammonium
(0.293) µg/g
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CAS登记号
备用CAS登记号
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分子式
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分子量
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精确质量测定
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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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1,1,2,2H-Perfluorooctanesulfonic acid
精确质量测定
427.9752
SMILES
OS(=O)(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C8H5F13O3S/c9-3(10,1-2-25(22,23)24)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21/h1-2H2,(H,22,23,24)
IUPAC
3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctane-1-sulfonic acid
Capstone Product B
精确质量测定
570.0858
SMILES
C[N+](C)(CCCNS(=O)(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)CC(=O)[O-]
InChI
InChI=1S/C15H19F13N2O4S/c1-30(2,8-9(31)32)6-3-5-29-35(33,34)7-4-10(16,17)11(18,19)12(20,21)13(22,23)14(24,25)15(26,27)28/h29H,3-8H2,1-2H3
IUPAC
2-[dimethyl-[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfonylamino)propyl]azaniumyl]acetate
N-[3-(Dimethylamino)propyl]perfluoro-1-hexanesulfonamide
精确质量测定
484.049
SMILES
CN(C)CCCNS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C11H13F13N2O2S/c1-26(2)5-3-4-25-29(27,28)11(23,24)9(18,19)7(14,15)6(12,13)8(16,17)10(20,21)22/h25H,3-5H2,1-2H3
IUPAC
N-[3-(dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonamide
N-[3-(perfluoro-1-hexanesulfonamido)propan-1-yl]-N,N,N-trimethylammonium
精确质量测定
498.0647
SMILES
C[N+](C)(C)CCC[N-]S(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(=O)=O
InChI
InChI=1S/C12H15F13N2O2S/c1-27(2,3)6-4-5-26-30(28,29)12(24,25)10(19,20)8(15,16)7(13,14)9(17,18)11(21,22)23/h4-6H2,1-3H3
IUPAC
1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl-[3-(trimethylazaniumyl)propyl]azanide
Perfluorobutane Sulfonamide
精确质量测定
298.9663
SMILES
NS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C4H2F9NO2S/c5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h(H2,14,15,16)
IUPAC
1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonamide
Perfluorobutanesulfonic acid
精确质量测定
299.9503
SMILES
OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C4HF9O3S/c5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h(H,14,15,16)
IUPAC
1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonic acid
Perfluorobutanoic acid
精确质量测定
213.9865
SMILES
OC(=O)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C4HF7O2/c5-2(6,1(12)13)3(7,8)4(9,10)11/h(H,12,13)
IUPAC
2,2,3,3,4,4,4-heptafluorobutanoic acid
Perfluoroheptanesulfonic acid
精确质量测定
449.9407
SMILES
OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C7HF15O3S/c8-1(9,2(10,11)4(14,15)6(18,19)20)3(12,13)5(16,17)7(21,22)26(23,24)25/h(H,23,24,25)
IUPAC
1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptane-1-sulfonic acid
Perfluoroheptanoic acid
精确质量测定
363.9769
SMILES
OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C7HF13O2/c8-2(9,1(21)22)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h(H,21,22)
IUPAC
2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoic acid
Perfluorohexane Sulfonamide
精确质量测定
398.9599
SMILES
NS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C6H2F13NO2S/c7-1(8,3(11,12)5(15,16)17)2(9,10)4(13,14)6(18,19)23(20,21)22/h(H2,20,21,22)
IUPAC
1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonamide
Perfluorohexanesulfonic acid
精确质量测定
399.9439
SMILES
OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C6HF13O3S/c7-1(8,3(11,12)5(15,16)17)2(9,10)4(13,14)6(18,19)23(20,21)22/h(H,20,21,22)
IUPAC
1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonic acid
Perfluorohexanoic acid
精确质量测定
313.9801
SMILES
OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C6HF11O2/c7-2(8,1(18)19)3(9,10)4(11,12)5(13,14)6(15,16)17/h(H,18,19)
IUPAC
2,2,3,3,4,4,5,5,6,6,6-undecafluorohexanoic acid
Perfluorooctanesulfonic acid
精确质量测定
499.9375
SMILES
OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C8HF17O3S/c9-1(10,3(13,14)5(17,18)7(21,22)23)2(11,12)4(15,16)6(19,20)8(24,25)29(26,27)28/h(H,26,27,28)
IUPAC
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonic acid
Perfluorooctanoic acid
精确质量测定
413.9737
SMILES
OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C8HF15O2/c9-2(10,1(24)25)3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)23/h(H,24,25)
IUPAC
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanoic acid
Perfluoropentanesulfonic Acid
精确质量测定
349.9471
SMILES
OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C5HF11O3S/c6-1(7,2(8,9)4(12,13)14)3(10,11)5(15,16)20(17,18)19/h(H,17,18,19)
IUPAC
1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonic acid
Perfluoropropanesulfonic Acid
精确质量测定
249.9535
SMILES
OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)F
InChI
InChI=1S/C3HF7O3S/c4-1(5,2(6,7)8)3(9,10)14(11,12)13/h(H,11,12,13)
IUPAC
1,1,2,2,3,3,3-heptafluoropropane-1-sulfonic acid
产品数据
存储温度
Room Temperature
运输温度
Room Temperature
原产国
UNITED STATES
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