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Substance Name: Calcium 3-methyl-2-oxobutyrate
RN: 51828-94-5
UNII: 00T4085CBX
InChIKey: IMZGMVJQWNJKCI-UHFFFAOYSA-L

Molecular Formula

  • C5-H8-O3.1/2Ca

Molecular Weight

  • 270.2926
 
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Names and Synonyms

Name of Substance

  • Calcium 3-methyl-2-oxobutyrate

Synonyms

  • 3-Methyl-2-oxobuttersaeure calciumsalz
  • EINECS 257-456-0
  • UNII-00T4085CBX

Systematic Name

  • Calcium 3-methyl-2-oxobutyrate (1:2)

Registry Numbers

CAS Registry Number

  • 51828-94-5

FDA UNII

  • 00T4085CBX

Related Registry Number

  • 759-05-7 (Parent)

System Generated Number

  • 0051828945

Molecular Formulas

Molecular Formula

  • C5-H8-O3.1/2Ca

Molecular Formula Fragments

  • C5-H8-O3
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C5H8O3.Ca/c2*1-3(2)4(6)5(7)8;/h2*3H,1-2H3,(H,7,8);/q;;+2/p-2

InChIKey

IMZGMVJQWNJKCI-UHFFFAOYSA-L

Smiles

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