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Substance Name: Octadecanoic acid, 10-(sulfooxy)-, 1-propyl ester, sodium salt (1:1)
RN: 140-00-1
InChIKey: CCLRUAXJCKJXAL-UHFFFAOYSA-M

Molecular Formula

  • C21-H42-O6-S.Na

Molecular Weight

  • 444.605
 
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Names and Synonyms

Synonym

  • EINECS 205-390-8

Systematic Names

  • Octadecanoic acid, 10-(sulfooxy)-, 1-propyl ester, sodium salt
  • Octadecanoic acid, 10-(sulfooxy)-, 1-propyl ester, sodium salt (1:1)
  • Sodium 1-propyl 10-(sulphooxy)octadecanoate

Registry Numbers

CAS Registry Number

  • 140-00-1

System Generated Number

  • 0000140001

Molecular Formulas

Molecular Formula

  • C21-H42-O6-S.Na

Molecular Formula Fragments

  • C21-H42-O6-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C21H42O6S.Na/c1-3-5-6-7-10-13-16-20(27-28(23,24)25)17-14-11-8-9-12-15-18-21(22)26-19-4-2;/h20H,3-19H2,1-2H3,(H,23,24,25);/q;+1/p-1

InChIKey

CCLRUAXJCKJXAL-UHFFFAOYSA-M

Smiles

S(=O)(=O)([O-])O[C@@H](CCCCCCCC)CCCCCCCCC(=O)OCCC.[Na+]