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CAS 98349-22-5

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2,4,5-Trifluorobenzonitrile

Description:
2,4,5-Trifluorobenzonitrile is an aromatic compound characterized by the presence of a benzene ring substituted with three fluorine atoms and a nitrile group (-C≡N). The fluorine atoms are located at the 2, 4, and 5 positions of the benzene ring, contributing to the compound's unique electronic and steric properties. This substitution pattern can influence the compound's reactivity, polarity, and solubility. 2,4,5-Trifluorobenzonitrile is typically a colorless to pale yellow liquid or solid, depending on temperature and purity. It is known for its applications in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals, due to the reactivity of the nitrile group and the electron-withdrawing effects of the fluorine atoms. The compound is also of interest in materials science and as an intermediate in various chemical reactions. Safety precautions should be taken when handling this substance, as it may pose health risks and environmental hazards.
Formula:C7H2F3N
InChI:InChI=1S/C7H2F3N/c8-5-2-7(10)6(9)1-4(5)3-11/h1-2H
InChI key:InChIKey=DLKNOGQOOZFICZ-UHFFFAOYSA-N
SMILES:C(#N)C1=C(F)C=C(F)C(F)=C1
Synonyms:
  • 2,4,5-Trifluorbenzolcarbonitril
  • Benzonitrile, 2,4,5-trifluoro-
  • Ncr Bf Df Ef
  • 2,4,5-Trifluorobenzonitrile
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