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Substance Name: 1-Propanaminium, 3-((carboxymethyl)((1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)sulfonyl)amino)-N,N,N-trimethyl-, inner salt
RN: 38850-52-1
InChIKey: PHLQZHXBMDKUNG-UHFFFAOYSA-N

Classification Code

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

Molecular Formula

  • C14-H17-F13-N2-O4-S

Molecular Weight

  • 556.338
 
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Names and Synonyms

Synonyms

  • EINECS 254-156-1
  • N,N,N-Trimethyl-3-(carboxymethyl((tridecafluorohexyl)sulfonyl)amino)-1-propanaminium hydroxide inner salt

Systematic Names

  • 1-Propanaminium, 3-((carboxymethyl)((1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)sulfonyl)amino)-N,N,N-trimethyl-, inner salt
  • 1-Propanaminium, 3-((carboxymethyl)((tridecafluorohexyl)sulfonyl)amino)-N,N,N-trimethyl-, inner salt
  • 3-((Carboxymethyl)((tridecafluorohexyl)sulphonyl)amino)propyltrimethylammonium hydroxide

Registry Numbers

CAS Registry Number

  • 38850-52-1

System Generated Number

  • 0038850521

Structure Descriptors

InChI

1S/C14H17F13N2O4S/c1-29(2,3)6-4-5-28(7-8(30)31)34(32,33)14(26,27)12(21,22)10(17,18)9(15,16)11(19,20)13(23,24)25/h4-7H2,1-3H3

InChIKey

PHLQZHXBMDKUNG-UHFFFAOYSA-N

Smiles

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