2-Methyl-4-phenylbutanoic acid

CAS Registry Number®

1949-41-3

CAS Name

2-Methyl-4-phenylbutanoic acid

Molecular Formula

C11H14O2

Molecular Mass

178.23

Cite this Page

2-Methyl-4-phenylbutanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1949-41-3 (retrieved 2024-11-24) (CAS RN: 1949-41-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    180 °C @ Press: 19 Torr

  • Density (2)

    1.042 g/cm³ @ Temp: 32 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H14O2/c1-9(11(12)13)7-8-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,12,13)

InChIKey

InChIKey=OCKZHEXBLOOGOC-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C(C)CCC=1C=CC=CC1

Other Names for this Substance

  • Benzenebutanoic acid, α-methyl-
  • Butyric acid, 2-methyl-4-phenyl-
  • α-Methylbenzenebutanoic acid
  • 2-Methyl-γ-phenylbutyric acid
  • 2-Methyl-4-phenylbutanoic acid

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Deleted or Replaced CAS Registry Numbers

143167-63-9, 1628063-46-6

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