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Substance Name: Calcium bis(12-hydroxystearate)
RN: 3159-62-4
UNII: V1I7239M6R
InChIKey: RXPKHKBYUIHIGL-UHFFFAOYSA-L

Molecular Formula

  • C18-H36-O3.1/2Ca

Molecular Weight

  • 639.021
 
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Names and Synonyms

Name of Substance

  • Calcium bis(12-hydroxystearate)

Synonyms

  • CCRIS 8268
  • EC 221-605-8
  • EINECS 221-605-8
  • UNII-V1I7239M6R

Systematic Names

  • Calcium(2+) 12-hydroxyoctadecanoate
  • Octadecanoic acid, 12-hydroxy-, calcium salt (2:1)

Superlist Name

  • Octadecanoic acid, 12-hydroxy-, calcium salt (2:1)

Registry Numbers

CAS Registry Number

  • 3159-62-4

FDA UNII

  • V1I7239M6R

Other Registry Number

  • 2087-08-3

System Generated Number

  • 0003159624

Molecular Formulas

Molecular Formula

  • C18-H36-O3.1/2Ca

Molecular Formula Fragments

  • C18-H36-O3
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C18H36O3.Ca/c2*1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21;/h2*17,19H,2-16H2,1H3,(H,20,21);/q;;+2/p-2

InChIKey

RXPKHKBYUIHIGL-UHFFFAOYSA-L

Smiles

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