2-Methyl-δ-oxobenzenepentanoic acid

CAS Registry Number®

36978-50-4
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CAS Name

2-Methyl-δ-oxobenzenepentanoic acid

Molecular Formula

C12H14O3

Molecular Mass

206.24

Cite this Page

2-Methyl-δ-oxobenzenepentanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=36978-50-4 (retrieved 2024-08-03) (CAS RN: 36978-50-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    80 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H14O3/c1-9-5-2-3-6-10(9)11(13)7-4-8-12(14)15/h2-3,5-6H,4,7-8H2,1H3,(H,14,15)

InChIKey

InChIKey=KCWMQVONXURDFY-UHFFFAOYSA-N

SMILES

C(CCCC(O)=O)(=O)C1=C(C)C=CC=C1

Canonical SMILES

O=C(O)CCCC(=O)C=1C=CC=CC1C

Other Names for this Substance

  • Benzenepentanoic acid, 2-methyl-δ-oxo-
  • 2-Methyl-δ-oxobenzenepentanoic acid
  • γ-(o-Methylbenzoyl)butyric acid
  • 5-Oxo-5-(o-tolyl)pentanoic acid