2,2,2-Trichloro-1-[4-(1,1-dimethylethyl)phenyl]ethanone

CAS Registry Number®

51326-37-5
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CAS Name

2,2,2-Trichloro-1-[4-(1,1-dimethylethyl)phenyl]ethanone

Molecular Formula

C12H13Cl3O

Molecular Mass

279.59

Cite this Page

2,2,2-Trichloro-1-[4-(1,1-dimethylethyl)phenyl]ethanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=51326-37-5 (retrieved 2024-09-01) (CAS RN: 51326-37-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H13Cl3O/c1-11(2,3)9-6-4-8(5-7-9)10(16)12(13,14)15/h4-7H,1-3H3

InChIKey

InChIKey=IMDHDEPPVWETOI-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Ethanone, 2,2,2-trichloro-1-[4-(1,1-dimethylethyl)phenyl]-
  • 2,2,2-Trichloro-1-[4-(1,1-dimethylethyl)phenyl]ethanone
  • 2,2,2-Trichloro-4′-tert-butylacetophenone
  • 4′-tert-Butyl-2,2,2-trichloroacetophenone
  • 4-tert-Butyl-α,α,α-trichloroacetophenone

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Deleted or Replaced CAS Registry Numbers

66231-34-3, 253312-75-3