Methyl 4-methyl-β-oxobenzenepropanoate

CAS Registry Number®

22027-51-6

CAS Name

Methyl 4-methyl-β-oxobenzenepropanoate

Molecular Formula

C11H12O3

Molecular Mass

192.21

Cite this Page

Methyl 4-methyl-β-oxobenzenepropanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=22027-51-6 (retrieved 2024-11-28) (CAS RN: 22027-51-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    190-192 °C @ Press: 41 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H12O3/c1-8-3-5-9(6-4-8)10(12)7-11(13)14-2/h3-6H,7H2,1-2H3

InChIKey

InChIKey=BIKPAXOCIFGWRJ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenepropanoic acid, 4-methyl-β-oxo-, methyl ester
  • Acetic acid, p-toluoyl-, methyl ester
  • Methyl 4-methyl-β-oxobenzenepropanoate
  • Methyl 3-(4-methylphenyl)-3-oxopropanoate
  • NSC 157310

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