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Substance Name: Octadecanoic acid, 12-(acetyloxy)-, calcium salt (2:1)
RN: 68171-61-9
InChIKey: OELKSGXMBPJHFW-UHFFFAOYSA-L

Molecular Formula

  • C20-H38-O4.1/2Ca

Molecular Weight

  • 723.095
 
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Names and Synonyms

Synonym

  • EINECS 269-033-8

Systematic Names

  • Calcium 12-(acetoxy)octadecanoate
  • Octadecanoic acid, 12-(acetyloxy)-, calcium salt
  • Octadecanoic acid, 12-(acetyloxy)-, calcium salt (2:1)

Registry Numbers

CAS Registry Number

  • 68171-61-9

System Generated Number

  • 0068171619

Molecular Formulas

Molecular Formula

  • C20-H38-O4.1/2Ca

Molecular Formula Fragments

  • C20-H38-O4
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C20H38O4.Ca/c2*1-3-4-5-12-15-19(24-18(2)21)16-13-10-8-6-7-9-11-14-17-20(22)23;/h2*19H,3-17H2,1-2H3,(H,22,23);/q;;+2/p-2

InChIKey

OELKSGXMBPJHFW-UHFFFAOYSA-L

Smiles

[O-]C(=O)CCCCCCCCCC[C@@H](OC(=O)C)CCCCCC.[O-]C(=O)CCCCCCCCCC[C@@H](CCCCCC)OC(=O)C.[Ca+2]