3,3-Dimethyl-4-phenyl-2-butanone

CAS Registry Number®

13705-37-8

CAS Name

3,3-Dimethyl-4-phenyl-2-butanone

Molecular Formula

C12H16O

Molecular Mass

176.25

Cite this Page

3,3-Dimethyl-4-phenyl-2-butanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13705-37-8 (retrieved 2024-11-25) (CAS RN: 13705-37-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    95 °C @ Press: 1.5 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H16O/c1-10(13)12(2,3)9-11-7-5-4-6-8-11/h4-8H,9H2,1-3H3

InChIKey

InChIKey=UBNAVIPKORDBNB-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 2-Butanone, 3,3-dimethyl-4-phenyl-
  • 3,3-Dimethyl-4-phenyl-2-butanone

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