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CAS 120077-70-5

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1-[4-Bromo-3-(trifluoromethyl)phenyl]ethanone

Description:
1-[4-Bromo-3-(trifluoromethyl)phenyl]ethanone, with the CAS number 120077-70-5, is an organic compound characterized by its distinctive functional groups and structural features. It contains a bromine atom and a trifluoromethyl group attached to a phenyl ring, which contributes to its unique chemical reactivity and physical properties. The presence of the ethanone functional group indicates that it is a ketone, which typically exhibits characteristic carbonyl (C=O) reactivity. This compound is likely to be a solid at room temperature, with potential applications in pharmaceuticals, agrochemicals, or as an intermediate in organic synthesis. Its bromine and trifluoromethyl substituents can enhance lipophilicity and influence biological activity, making it of interest in medicinal chemistry. Additionally, the trifluoromethyl group is known for imparting unique electronic properties, which can affect the compound's stability and reactivity. Safety data should be consulted for handling, as halogenated compounds can pose environmental and health risks.
Formula:C9H6BrF3O
InChI:InChI=1S/C9H6BrF3O/c1-5(14)6-2-3-8(10)7(4-6)9(11,12)13/h2-4H,1H3
InChI key:InChIKey=PXWQPRQCBQCKFI-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=CC(C(C)=O)=CC=C1Br
Synonyms:
  • 1-[4-Bromo-3-(trifluoromethyl)phenyl]ethanone
  • 4-Bromo-3-trifluoromethylacetophenone
  • 1-[4-Bromo-3-(trifluoromethyl)phenyl]-1-ethanone
  • Ethanone, 1-[4-bromo-3-(trifluoromethyl)phenyl]-
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