β,β,4-Trimethylbenzenepropanoic acid

CAS Registry Number®

42288-08-4

CAS Name

β,β,4-Trimethylbenzenepropanoic acid

Molecular Formula

C12H16O2

Molecular Mass

192.25

Cite this Page

β,β,4-Trimethylbenzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=42288-08-4 (retrieved 2024-11-30) (CAS RN: 42288-08-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    76.5-77 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H16O2/c1-9-4-6-10(7-5-9)12(2,3)8-11(13)14/h4-7H,8H2,1-3H3,(H,13,14)

InChIKey

InChIKey=LXMASNUOAKLCJK-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenepropanoic acid, β,β,4-trimethyl-
  • Hydrocinnamic acid, p,β,β-trimethyl-
  • β,β,4-Trimethylbenzenepropanoic acid
  • 3-Methyl-3-(4-methylphenyl)butanoic acid
  • 3-Methyl-3-(4-methylphenyl)butyric acid

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