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Substance Name: Hexanoic acid, 2-sulfo-, 1-(2-ethylhexyl) ester, sodium salt (1:1)
RN: 67845-72-1
InChIKey: MEHUGYNZFGQPCM-UHFFFAOYSA-M

Molecular Formula

  • C14-H28-O5-S.Na

Molecular Weight

  • 330.418
 
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Names and Synonyms

Synonyms

  • alpha-Sulfo 2-ethylhexyl caproate, sodium salt
  • Sodium 1-(2-ethylhexyl) 2-sulfohexanoate

Systematic Names

  • Hexanoic acid, 2-sulfo-, 1-(2-ethylhexyl) ester, sodium salt
  • Hexanoic acid, 2-sulfo-, 1-(2-ethylhexyl) ester, sodium salt (1:1)

Registry Numbers

CAS Registry Number

  • 67845-72-1

System Generated Number

  • 0067845721

Molecular Formulas

Molecular Formula

  • C14-H28-O5-S.Na

Molecular Formula Fragments

  • C14-H28-O5-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C14H28O5S.Na/c1-4-7-9-12(6-3)11-19-14(15)13(10-8-5-2)20(16,17)18;/h12-13H,4-11H2,1-3H3,(H,16,17,18);/q;+1/p-1

InChIKey

MEHUGYNZFGQPCM-UHFFFAOYSA-M

Smiles

S(=O)(=O)([O-])[C@@H](CCCC)C(=O)OC[C@@H](CCCC)CC.[Na+]