Pentanoic acid, 3-methyl-2-oxo-, calcium salt (2:1), (3S)-

CAS Registry Number®

51828-96-7

CAS Name

Pentanoic acid, 3-methyl-2-oxo-, calcium salt (2:1), (3S)-

Molecular Formula

C6H10O3.1/2Ca

Cite this Page

Pentanoic acid, 3-methyl-2-oxo-, calcium salt (2:1), (3S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=51828-96-7 (retrieved 2025-01-03) (CAS RN: 51828-96-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C6H10O3.Ca/c1-3-4(2)5(7)6(8)9;/h4H,3H2,1-2H3,(H,8,9);/t4-;/m0./s1

InChIKey

InChIKey=PJSMJIFOGLEATM-WCCKRBBISA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Pentanoic acid, 3-methyl-2-oxo-, calcium salt (2:1), (3S)-
  • Pentanoic acid, 3-methyl-2-oxo-, calcium salt, (3S)-
  • Pentanoic acid, 3-methyl-2-oxo-, calcium salt, (S)-

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