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Substance Name: Behenoyl PG-trimonium chloride
RN: 69537-38-8
UNII: 79O72LEW2A
InChIKey: GGFDFNHQSGONII-UHFFFAOYSA-M

Molecular Formula

  • C28-H58-N-O3.Cl

Molecular Weight

  • 492.2232
 
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Names and Synonyms

Name of Substance

  • (3-Behenoyloxy-2-hydroxypropyl)trimethyl ammonium chloride
  • Behenoyl PG-trimonium chloride

Synonyms

  • EINECS 274-033-6
  • UNII-79O72LEW2A

Systematic Name

  • 2-Hydroxy-3-((1-oxodocosyl)oxy)propyltrimethylammonium chloride

Registry Numbers

CAS Registry Number

  • 69537-38-8

FDA UNII

  • 79O72LEW2A

System Generated Number

  • 0069537388

Molecular Formulas

Molecular Formula

  • C28-H58-N-O3.Cl

Molecular Formula Fragments

  • C28-H58-N-O3
  • Cl
  • COMPONENT

Structure Descriptors

InChI

InChI=1S/C28H58NO3.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28(31)32-26-27(30)25-29(2,3)4;/h27,30H,5-26H2,1-4H3;1H/q+1;/p-1

InChIKey

GGFDFNHQSGONII-UHFFFAOYSA-M

Smiles

[Cl-].CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(O)C[N+](C)(C)C