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Substance Name: 1-Propanaminium, 3-(((1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)sulfonyl)(3-sulfopropyl)amino)-N-(2-hydroxyethyl)-N,N-dimethyl-, inner salt
RN: 68298-11-3
InChIKey: SNTCPXZDMUXYEP-UHFFFAOYSA-N

Classification Code

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

Molecular Formula

  • C18-H23-F17-N2-O6-S2

Molecular Weight

  • 750.486
 
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Names and Synonyms

Synonyms

  • EINECS 269-540-4
  • N,N-Dimethyl-3-(((heptadecafluorooctyl)sulfonyl(N-(3-sulfopropyl))amino)-N-(2-hydroxyethyl)-1-propanaminium hydroxide inner salt

Systematic Names

  • (3-(((Heptadecafluorooctyl)sulphonyl)(3-sulphopropyl)amino)propyl)(2-hydroxyethyl)dimethylammonium hydroxide
  • 1-Propanaminium, 3-(((1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)sulfonyl)(3-sulfopropyl)amino)-N-(2-hydroxyethyl)-N,N-dimethyl-, inner salt
  • 1-Propanaminium, 3-(((heptadecafluorooctyl)sulfonyl)(3-sulfopropyl)amino)-N-(2-hydroxyethyl)-N,N-dimethyl-, hydroxide, inner salt
  • 1-Propanaminium, 3-(((heptadecafluorooctyl)sulfonyl)(3-sulfopropyl)amino)-N-(2-hydroxyethyl)-N,N-dimethyl-, inner salt

Registry Numbers

CAS Registry Number

  • 68298-11-3

System Generated Number

  • 0068298113

Structure Descriptors

InChI

1S/C18H23F17N2O6S2/c1-37(2,8-9-38)7-3-5-36(6-4-10-44(39,40)41)45(42,43)18(34,35)16(29,30)14(25,26)12(21,22)11(19,20)13(23,24)15(27,28)17(31,32)33/h3-10H2,1-2H3,(H,39,40,41)

InChIKey

SNTCPXZDMUXYEP-UHFFFAOYSA-N

Smiles

C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(S([N@@](CCCS(=O)(=O)O)CCC[N+](CC[O-])(C)C)(=O)=O)(F)F