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CAS 208173-22-2

:

1-(2,3,6-Trifluorophenyl)ethanone

Description:
1-(2,3,6-Trifluorophenyl)ethanone, with the CAS number 208173-22-2, is an organic compound characterized by its ketone functional group and a trifluorophenyl substituent. This compound features a phenyl ring that is substituted with three fluorine atoms at the 2, 3, and 6 positions, which significantly influences its chemical properties, including increased electronegativity and potential reactivity. The presence of the trifluoromethyl group enhances its lipophilicity and may affect its biological activity, making it of interest in pharmaceutical and agrochemical research. The compound is typically a colorless to pale yellow liquid or solid, depending on the temperature and purity. Its molecular structure contributes to its stability and potential applications in synthesis and as an intermediate in various chemical reactions. Additionally, the trifluoromethyl group can impart unique characteristics such as increased metabolic stability and altered solubility, which are valuable in drug design and development. Safety data should be consulted for handling and storage, as fluorinated compounds can exhibit specific hazards.
Formula:C8H5F3O
InChI:InChI=1S/C8H5F3O/c1-4(12)7-5(9)2-3-6(10)8(7)11/h2-3H,1H3
InChI key:InChIKey=INDGVPJYDRJJPJ-UHFFFAOYSA-N
SMILES:C(C)(=O)C1=C(F)C(F)=CC=C1F
Synonyms:
  • 1-(2,3,6-Trifluorophenyl)Ethanone
  • 1-(2,3,6-Trifluorophenyl)ethan-1-one
  • 2',3',6'-Trifluoroacetophenone
  • Ethanone, 1-(2,3,6-trifluorophenyl)-
  • 2′,3′,6′-Trifluoroacetophenone
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