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Substance Name: 1-Tridecanol, 1-(hydrogen sulfate), calcium salt (2:1)
RN: 72018-28-1
InChIKey: BPHNWTCKJLHIIA-UHFFFAOYSA-L

Molecular Formula

  • C13-H28-O4-S.1/2Ca

Molecular Weight

  • 598.915
 
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Names and Synonyms

Synonyms

  • Calcium tridecyl sulfate
  • EINECS 276-303-9

Systematic Names

  • 1-Tridecanol, 1-(hydrogen sulfate), calcium salt (2:1)
  • 1-Tridecanol, hydrogen sulfate, calcium salt
  • Calcium tridecan-1-yl sulphate

Registry Numbers

CAS Registry Number

  • 72018-28-1

System Generated Number

  • 0072018281

Molecular Formulas

Molecular Formula

  • C13-H28-O4-S.1/2Ca

Molecular Formula Fragments

  • C13-H28-O4-S
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C13H28O4S.Ca/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-17-18(14,15)16;/h2*2-13H2,1H3,(H,14,15,16);/q;;+2/p-2

InChIKey

BPHNWTCKJLHIIA-UHFFFAOYSA-L

Smiles

[Ca+2].C(OS(=O)(=O)[O-])CCCCCCCCCCCC.C(CCCCCCCCCCCC)OS(=O)(=O)[O-]