4-Chloro-1-(2-methylphenyl)-1-butanone

CAS Registry Number®

40877-13-2

CAS Name

4-Chloro-1-(2-methylphenyl)-1-butanone

Molecular Formula

C11H13ClO

Molecular Mass

196.67

Cite this Page

4-Chloro-1-(2-methylphenyl)-1-butanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=40877-13-2 (retrieved 2024-11-22) (CAS RN: 40877-13-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    140-142 °C @ Press: 7 Torr

  • Density (1)

    1.1091 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H13ClO/c1-9-5-2-3-6-10(9)11(13)7-4-8-12/h2-3,5-6H,4,7-8H2,1H3

InChIKey

InChIKey=LPKLQNWSXICBIQ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(C=1C=CC=CC1C)CCCCl

Other Names for this Substance

  • 1-Butanone, 4-chloro-1-(2-methylphenyl)-
  • Butyrophenone, 4-chloro-2′-methyl-
  • 4-Chloro-1-(2-methylphenyl)-1-butanone
  • 4-Chloro-1-(o-tolyl)butan-1-one

CAS INSIGHTSTM
Targeted protein degrader structure, illustration