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Substance Name: Benzoic acid, 2,3,4,5-tetrachloro-6-(((3-(((1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)sulfonyl)oxy)phenyl)amino)carbonyl)-, potassium salt (1:1)
RN: 68815-72-5
InChIKey: IOTKRYWDXPLNIV-UHFFFAOYSA-M

Classification Code

  • TSCA Flag S (Substance is Identified in a Proposed or Final SNUR (Significant New Use Rule) under TSCA)

Molecular Formula

  • C20-H6-Cl4-F13-N-O6-S.K

Molecular Weight

  • 815.211
 
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Names and Synonyms

Synonyms

  • 2,3,4,5-Tetrachloro-6-((3-(tridecafluorohexyl)sulfonyloxy)phenylaminocarbonyl)benzoic acid, potassium salt
  • EINECS 272-390-2

Systematic Names

  • Benzoic acid, 2,3,4,5-tetrachloro-6-(((3-(((1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)sulfonyl)oxy)phenyl)amino)carbonyl)-, potassium salt (1:1)
  • Benzoic acid, 2,3,4,5-tetrachloro-6-(((3-(((tridecafluorohexyl)sulfonyl)oxy)phenyl)amino)carbonyl)-, monopotassium salt
  • Potassium 2,3,4,5-tetrachloro-6-(((3-(((tridecafluorohexyl)sulphonyl)oxy)phenyl)amino)carbonyl)benzoate

Registry Numbers

CAS Registry Number

  • 68815-72-5

System Generated Number

  • 0068815725

Molecular Formulas

Molecular Formula

  • C20-H6-Cl4-F13-N-O6-S.K

Molecular Formula Fragments

  • C20-H6-Cl4-F13-N-O6-S
  • COMPONENT
  • K

Structure Descriptors

InChI

1S/C20H6Cl4F13NO6S.K/c21-9-7(8(14(40)41)10(22)12(24)11(9)23)13(39)38-5-2-1-3-6(4-5)44-45(42,43)20(36,37)18(31,32)16(27,28)15(25,26)17(29,30)19(33,34)35;/h1-4H,(H,38,39)(H,40,41);/q;+1/p-1

InChIKey

IOTKRYWDXPLNIV-UHFFFAOYSA-M

Smiles

C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(S(Oc1cc(NC(c2c(c(Cl)c(c(c2Cl)Cl)Cl)C(=O)[O-])=O)ccc1)(=O)=O)(F)F.[K+]