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Substance Name: Octanoic acid, 2-sulfo-, 1-(2-ethylhexyl) ester, ammonium salt (1:1)
RN: 67845-75-4
InChIKey: MCVJSIWSTNOXPO-UHFFFAOYSA-N

Molecular Formula

  • C16-H32-O5-S.H3-N

Molecular Weight

  • 353.521
 
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Names and Synonyms

Synonyms

  • alpha-Sulfo 2-ethylhexyl caprylate, ammonium salt
  • Ammonium 1-(2-ethylhexyl) 2-sulfooctanoate

Systematic Names

  • Octanoic acid, 2-sulfo-, 1-(2-ethylhexyl) ester, ammonium salt
  • Octanoic acid, 2-sulfo-, 1-(2-ethylhexyl) ester, ammonium salt (1:1)

Registry Numbers

CAS Registry Number

  • 67845-75-4

System Generated Number

  • 0067845754

Molecular Formulas

Molecular Formula

  • C16-H32-O5-S.H3-N

Molecular Formula Fragments

  • C16-H32-O5-S
  • COMPONENT
  • H3-N

Structure Descriptors

InChI

1S/C16H32O5S.H3N/c1-4-7-9-10-12-15(22(18,19)20)16(17)21-13-14(6-3)11-8-5-2;/h14-15H,4-13H2,1-3H3,(H,18,19,20);1H3

InChIKey

MCVJSIWSTNOXPO-UHFFFAOYSA-N

Smiles

S(=O)(=O)(O)[C@@H](CCCCCC)C(=O)OC[C@@H](CCCC)CC.N