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Substance Name: Isoamyl acetoacetate
RN: 2308-18-1
UNII: 4QVH533ZIY
InChIKey: XHRGPLDMNNGHCX-UHFFFAOYSA-N

Molecular Formula

  • C9-H16-O3

Molecular Weight

  • 172.222
 
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Names and Synonyms

Name of Substance

  • Isoamyl acetoacetate

Synonyms

  • 3-Methylbutyl 3-oxobutanoate
  • 3-Methylbutyl acetoacetate
  • 3-Methylbutyl beta-ketobutyrate
  • Acetoacetic acid, isopentyl ester
  • Butanoic acid, 3-oxo-, 3-methylbutyl ester
  • EINECS 218-991-5
  • FEMA No. 3551
  • Isoamyl 3-oxobutanoate
  • Isoamyl acetoacetate
  • Isoamyl acetylacetate
  • Isoamyl beta-ketobutyrate
  • Isopentyl 3-oxobutanoate
  • Isopentyl acetoacetate
  • Isopentyl beta-ketobutyrate
  • UNII-4QVH533ZIY

Systematic Names

  • Butanoic acid, 3-oxo-, 3-methylbutyl ester
  • Isopentyl acetoacetate

Superlist Name

  • Isoamyl acetoacetate

Registry Numbers

CAS Registry Number

  • 2308-18-1

FDA UNII

  • 4QVH533ZIY

System Generated Number

  • 0002308181

Structure Descriptors

InChI

1S/C9H16O3/c1-7(2)4-5-12-9(11)6-8(3)10/h7H,4-6H2,1-3H3

InChIKey

XHRGPLDMNNGHCX-UHFFFAOYSA-N

Smiles

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