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Substance Name: alpha-Ketoisocaproic acid
RN: 816-66-0
UNII: 4GUJ8AH400
InChIKey: BKAJNAXTPSGJCU-UHFFFAOYSA-N

Molecular Formula

  • C6-H10-O3

Molecular Weight

  • 130.142
 
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Names and Synonyms

Name of Substance

  • alpha-Ketoisocaproic acid

Synonyms

  • 4-Methyl-2-oxovaleric acid
  • alpha-Ketoisocaproic acid
  • EINECS 212-435-5
  • UNII-4GUJ8AH400

Systematic Names

  • 4-Methyl-2-oxopentanoic acid
  • 4-Methyl-2-oxovaleric acid
  • Pentanoic acid, 4-methyl-2-oxo-

Superlist Name

  • 4-Methyl-2-oxovaleric acid

Registry Numbers

CAS Registry Number

  • 816-66-0

FDA UNII

  • 4GUJ8AH400

Related Registry Numbers

  • 4502-00-5 (hydrochloride salt)
  • 51828-95-6 (calcium salt)

System Generated Number

  • 0000816660

Structure Descriptors

InChI

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

InChIKey

BKAJNAXTPSGJCU-UHFFFAOYSA-N

Smiles

C(CC(C)C)(C(O)=O)=O