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Substance Name: N-Ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-(2-hydroxyethyl)-1-octanesulfonamide dihydrogen phosphate ester
RN: 3820-83-5
UNII: 2WAL15E46N
InChIKey: JRSUJBJSUYPODE-UHFFFAOYSA-N

Classification Code

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

Molecular Formula

  • C12-H11-F17-N-O6-P-S

Molecular Weight

  • 651.226
 
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Names and Synonyms

Name of Substance

  • N-Ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-(2-hydroxyethyl)-1-octanesulfonamide dihydrogen phosphate ester

Synonyms

  • EINECS 223-317-8
  • UNII-2WAL15E46N

Systematic Names

  • 1-Octanesulfonamide, N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-(2-(phosphonooxy)ethyl)-
  • N-Ethylheptadecafluoro-N-(2-(phosphonooxy)ethyl)octanesulphonamide

Registry Numbers

CAS Registry Number

  • 3820-83-5

FDA UNII

  • 2WAL15E46N

Related Registry Number

  • 67969-69-1 (diammonium salt)

System Generated Number

  • 0003820835

Structure Descriptors

InChI

1S/C12H11F17NO6PS/c1-2-30(3-4-36-37(31,32)33)38(34,35)12(28,29)10(23,24)8(19,20)6(15,16)5(13,14)7(17,18)9(21,22)11(25,26)27/h2-4H2,1H3,(H2,31,32,33)

InChIKey

JRSUJBJSUYPODE-UHFFFAOYSA-N

Smiles

O=P(OCC[N@@](S(=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)CC)(O)O