Benzyl isovalerate

CAS Registry Number®

103-38-8

CAS Name

Benzyl isovalerate

Molecular Formula

C12H16O2

Molecular Mass

192.25

Cite this Page

Benzyl isovalerate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=103-38-8 (retrieved 2024-11-22) (CAS RN: 103-38-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    245 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C12H16O2/c1-10(2)8-12(13)14-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3

InChIKey

InChIKey=HVJKZICIMIWFCP-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Butanoic acid, 3-methyl-, phenylmethyl ester
  • Isovaleric acid, benzyl ester
  • Benzyl isovalerate
  • Benzyl 3-methylbutyrate
  • Benzyl 3-methylbutanoate

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