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Substance Name: Benzenesulfonic acid, isodecyl-, calcium salt (2:1)
RN: 67890-05-5
InChIKey: OOVMJAYMJZBIQO-UHFFFAOYSA-L

Molecular Formula

  • C16-H26-O3-S.1/2Ca

Molecular Weight

  • 634.951
 
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Names and Synonyms

Synonyms

  • Calcium isodecylbenzenesulfonate
  • EINECS 267-558-7

Systematic Names

  • Benzenesulfonic acid, isodecyl-, calcium salt
  • Benzenesulfonic acid, isodecyl-, calcium salt (2:1)
  • Calcium isodecylbenzenesulphonate

Registry Numbers

CAS Registry Number

  • 67890-05-5

System Generated Number

  • 0067890055

Molecular Formulas

Molecular Formula

  • C16-H26-O3-S.1/2Ca

Molecular Formula Fragments

  • C16-H26-O3-S
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C16H26O3S.Ca/c2*1-14(2)10-6-4-3-5-7-11-15-12-8-9-13-16(15)20(17,18)19;/h2*8-9,12-14H,3-7,10-11H2,1-2H3,(H,17,18,19);/q;;+2/p-2

InChIKey

OOVMJAYMJZBIQO-UHFFFAOYSA-L

Smiles

[Ca+2].c1(c(CCCCCCCC(C)C)cccc1)S(=O)(=O)[O-].c1(c(cccc1)CCCCCCCC(C)C)S(=O)(=O)[O-]