4-Chloro-1-(2,5-dimethylphenyl)-1-butanone

CAS Registry Number®

71526-84-6

CAS Name

4-Chloro-1-(2,5-dimethylphenyl)-1-butanone

Molecular Formula

C12H15ClO

Molecular Mass

210.70

Cite this Page

4-Chloro-1-(2,5-dimethylphenyl)-1-butanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=71526-84-6 (retrieved 2024-11-08) (CAS RN: 71526-84-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    142-148 °C @ Press: 7 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H15ClO/c1-9-5-6-10(2)11(8-9)12(14)4-3-7-13/h5-6,8H,3-4,7H2,1-2H3

InChIKey

InChIKey=RLXPXHOSBRQERJ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(C1=CC(=CC=C1C)C)CCCCl

Other Names for this Substance

  • 1-Butanone, 4-chloro-1-(2,5-dimethylphenyl)-
  • Butyrophenone, 4-chloro-2′,5′-dimethyl-
  • 4-Chloro-1-(2,5-dimethylphenyl)-1-butanone
  • 4-Chloro-2′,5′-dimethylbutyrophenone
  • NSC 163131

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