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Substance Name: Dioleoylethyl hydroxyethylmonium methosulfate
RN: 94095-35-9
UNII: 5UXX651CBS
InChIKey: LEEPBJHNOBBYOU-YIQDKWKASA-M

Molecular Weight

  • 804.2195
 
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Names and Synonyms

Name of Substance

  • Dioleoylethyl hydroxyethylmonium methosulfate

Synonyms

  • EINECS 302-242-5
  • UNII-5UXX651CBS

Systematic Name

  • 9-Octadecenoic acid (Z)-, reaction products with triethanolamine, di-Me sulfate-quaternized

Registry Numbers

CAS Registry Number

  • 94095-35-9

FDA UNII

  • 5UXX651CBS

System Generated Number

  • 0094095359

Structure Descriptors

InChI

1S/C43H82NO5.CH4O4S/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-42(46)48-40-37-44(3,36-39-45)38-41-49-43(47)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2;1-5-6(2,3)4/h18-21,45H,4-17,22-41H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1/b20-18-,21-19-;

InChIKey

LEEPBJHNOBBYOU-YIQDKWKASA-M

Smiles

CCCCCCCC/C=C\CCCCCCCC(=O)OCC[N+](CCOC(=O)CCCCCCC/C=C\CCCCCCCC)(CCO)C.COS(=O)(=O)[O-]