Calcium α-ketoisocaproate

CAS Registry Number®

51828-95-6

CAS Name

Calcium α-ketoisocaproate

Molecular Formula

C6H10O3.1/2Ca

Cite this Page

Calcium α-ketoisocaproate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=51828-95-6 (retrieved 2024-11-22) (CAS RN: 51828-95-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C6H10O3.Ca/c1-4(2)3-5(7)6(8)9;/h4H,3H2,1-2H3,(H,8,9);

InChIKey

InChIKey=YJAKVPKJJMFDNW-UHFFFAOYSA-N

SMILES

C(CC(C)C)(C(O)=O)=O.[Ca]

Canonical SMILES

[Ca].O=C(O)C(=O)CC(C)C

Other Names for this Substance

  • Pentanoic acid, 4-methyl-2-oxo-, calcium salt (2:1)
  • Pentanoic acid, 4-methyl-2-oxo-, calcium salt
  • α-Ketoisocaproic acid calcium salt
  • Calcium α-oxoisocaproate
  • Calcium α-ketoisocaproate

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Deleted or Replaced CAS Registry Numbers

95017-02-0, 196884-11-4