Methyl 4-phenylbutyrate

CAS Registry Number®

2046-17-5

CAS Name

Methyl 4-phenylbutyrate

Molecular Formula

C11H14O2

Molecular Mass

178.23

Cite this Page

Methyl 4-phenylbutyrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2046-17-5 (retrieved 2024-11-24) (CAS RN: 2046-17-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    181 °C @ Press: 18 Torr

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=YRYZGVBKMWFWGT-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OC)CCCC=1C=CC=CC1

Other Names for this Substance

  • Benzenebutanoic acid, methyl ester
  • Butyric acid, 4-phenyl-, methyl ester
  • Methyl 4-phenylbutyrate
  • Methyl 4-phenylbutanoate
  • NSC 133895

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