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Substance Name: Propanoic acid, 3-(octadecylthio)-, barium salt (2:1)
RN: 38952-51-1
InChIKey: IBXOVGVKIOWOEQ-UHFFFAOYSA-L

Molecular Formula

  • C21-H42-O2-S.1/2Ba

Molecular Weight

  • 852.568
 
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Names and Synonyms

Synonyms

  • Barium 3-octadecylthiopropionate
  • Barium 3-stearylthiopropionate
  • EINECS 254-215-1

Systematic Names

  • Barium bis(3-(octadecylthio)propionate)
  • Propanoic acid, 3-(octadecylthio)-, barium salt
  • Propanoic acid, 3-(octadecylthio)-, barium salt (2:1)

Registry Numbers

CAS Registry Number

  • 38952-51-1

System Generated Number

  • 0038952511

Molecular Formulas

Molecular Formula

  • C21-H42-O2-S.1/2Ba

Molecular Formula Fragments

  • Ba
  • C21-H42-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/2C21H42O2S.Ba/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-24-20-18-21(22)23;/h2*2-20H2,1H3,(H,22,23);/q;;+2/p-2

InChIKey

IBXOVGVKIOWOEQ-UHFFFAOYSA-L

Smiles

[Ba+2].C(CCSCCCCCCCCCCCCCCCCCC)(=O)[O-].C(CCSCCCCCCCCCCCCCCCCCC)(=O)[O-]