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Substance Name: Calcium isohexadecanoate
RN: 95934-92-2
InChIKey: SYUYMDIBFKKQEK-UHFFFAOYSA-L

Molecular Formula

  • C16-H32-O2.1/2Ca

Molecular Weight

  • 550.9158
 
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Names and Synonyms

Synonym

  • EINECS 306-087-4

Systematic Name

  • Calcium isohexadecanoate

Registry Numbers

CAS Registry Number

  • 95934-92-2

System Generated Number

  • 0095934922

Molecular Formulas

Molecular Formula

  • C16-H32-O2.1/2Ca

Molecular Formula Fragments

  • C16-H32-O2
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C16H32O2.Ca/c2*1-15(2)13-11-9-7-5-3-4-6-8-10-12-14-16(17)18;/h2*15H,3-14H2,1-2H3,(H,17,18);/q;;+2/p-2

InChIKey

SYUYMDIBFKKQEK-UHFFFAOYSA-L

Smiles

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