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Substance Name: Ethanaminium, 2-hydroxy-N,N-dimethyl-N-(2-((1-oxooctadecyl)oxy)ethyl)-, methyl sulfate (1:1)
RN: 72829-20-0
InChIKey: BHDSLTCRNSUBNM-UHFFFAOYSA-M

Molecular Formula

  • C24-H50-N-O3.C-H3-O4-S

Molecular Weight

  • 511.7597
 
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Names and Synonyms

Synonym

  • (2-(Stearoyloxy)ethyl)(2-hydroxyethyl)dimethylammonium methosulfate

Systematic Names

  • Ethanaminium, 2-hydroxy-N,N-dimethyl-N-(2-((1-oxooctadecyl)oxy)ethyl)-, methyl sulfate (1:1)
  • Ethanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-2-((1-oxooctadecyl)oxy)-, methyl sulfate (salt)

Registry Numbers

CAS Registry Number

  • 72829-20-0

System Generated Number

  • 0072829200

Molecular Formulas

Molecular Formula

  • C24-H50-N-O3.C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C24-H50-N-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C24H50NO3.CH4O4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24(27)28-23-21-25(2,3)20-22-26;1-5-6(2,3)4/h26H,4-23H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1

InChIKey

BHDSLTCRNSUBNM-UHFFFAOYSA-M

Smiles

CCCCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)CCO.COS(=O)(=O)[O-]