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Substance Name: Calcium octanoate
RN: 6107-56-8
UNII: 606VZD154T
InChIKey: NDWWLJQHOLSEHX-UHFFFAOYSA-L

Molecular Formula

  • C8-H16-O2.1/2Ca

Molecular Weight

  • 326.487
 
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Names and Synonyms

Name of Substance

  • Calcium octanoate

Synonyms

  • Calcium octanoate
  • EINECS 228-067-3
  • UNII-606VZD154T

Systematic Names

  • Calcium di(octanoate)
  • Octanoic acid, calcium salt
  • Octanoic acid, calcium salt (2:1)

Superlist Name

  • Calcium octanoate

Registry Numbers

CAS Registry Number

  • 6107-56-8

FDA UNII

  • 606VZD154T

Other Registry Number

  • 55852-90-9

Related Registry Number

  • 124-07-2 (Parent)

System Generated Number

  • 0006107568

Molecular Formulas

Molecular Formula

  • C8-H16-O2.1/2Ca

Molecular Formula Fragments

  • C8-H16-O2
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C8H16O2.Ca/c2*1-2-3-4-5-6-7-8(9)10;/h2*2-7H2,1H3,(H,9,10);/q;;+2/p-2

InChIKey

NDWWLJQHOLSEHX-UHFFFAOYSA-L

Smiles

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