1-Phenyl-3-hexanone

CAS Registry Number®

29898-25-7

CAS Name

1-Phenyl-3-hexanone

Molecular Formula

C12H16O

Molecular Mass

176.25

Cite this Page

1-Phenyl-3-hexanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=29898-25-7 (retrieved 2024-11-21) (CAS RN: 29898-25-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    263 °C @ Press: 760 Torr

  • Density (1)

    0.9719 g/cm³ @ Temp: 40 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H16O/c1-2-6-12(13)10-9-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3

InChIKey

InChIKey=CWWWHACKSNBBMU-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 3-Hexanone, 1-phenyl-
  • 1-Phenyl-3-hexanone
  • Phenethyl propyl ketone