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CAS 2338-75-2

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4-(Trifluoromethyl)benzeneacetonitrile

Description:
4-(Trifluoromethyl)benzeneacetonitrile, with the CAS number 2338-75-2, is an organic compound characterized by the presence of a trifluoromethyl group (-CF3) attached to a benzene ring, along with an acetonitrile functional group (-C≡N). This compound typically appears as a colorless to pale yellow liquid or solid, depending on its physical state at room temperature. It is known for its relatively low volatility and high stability due to the strong carbon-fluorine bonds in the trifluoromethyl group. The presence of the cyano group contributes to its polarity, making it soluble in polar organic solvents. 4-(Trifluoromethyl)benzeneacetonitrile is often utilized in organic synthesis and pharmaceutical research, serving as an intermediate in the production of various chemical compounds. Its unique electronic properties, influenced by the electronegative fluorine atoms, can enhance reactivity in certain chemical reactions, making it a valuable compound in synthetic chemistry. Safety precautions should be taken when handling this substance, as it may pose health risks if inhaled or ingested.
Formula:C9H6F3N
InChI:InChI=1S/C9H6F3N/c10-9(11,12)8-3-1-7(2-4-8)5-6-13/h1-4H,5H2
InChI key:InChIKey=QNKOCFJZJWOXDE-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=CC=C(CC#N)C=C1
Synonyms:
  • (α,α,α-Trifluoro-p-tolyl)acetonitrile
  • 2-[4-(Trifluoromethyl)phenyl]acetonitrile
  • 4-(Trifluoromethyl)benzeneacetonitrile
  • 4-Trifluoromethylbenzeneacetonitrile
  • 4-Trifluoromethylbenzyl cyanide
  • Acetonitrile, (α,α,α-trifluoro-p-tolyl)-
  • Benzeneacetonitrile, 4-(trifluoromethyl)-
  • Nc1R Dxfff
  • [4-(Trifluoromethyl)phenyl]acetonitrile
  • p-(Trifluoromethyl)phenylacetonitrile
  • See more synonyms
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