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CAS 916420-65-0

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3,6-Dichloro-2-fluorobenzonitrile

Description:
3,6-Dichloro-2-fluorobenzonitrile is an organic compound characterized by its aromatic structure, which includes a benzene ring substituted with two chlorine atoms and one fluorine atom, along with a nitrile functional group. The presence of the nitrile group (-C≡N) contributes to its polarity and potential reactivity, making it useful in various chemical syntheses. The chlorine and fluorine substituents enhance the compound's lipophilicity and may influence its biological activity, making it of interest in pharmaceutical and agrochemical research. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its molecular structure suggests potential applications in the development of agrochemicals or pharmaceuticals, particularly in the synthesis of more complex molecules. Safety data should be consulted for handling, as halogenated compounds can pose environmental and health risks. Overall, 3,6-Dichloro-2-fluorobenzonitrile is a valuable compound in synthetic organic chemistry, with properties that warrant further investigation for various applications.
Formula:C7H2Cl2FN
InChI:InChI=1S/C7H2Cl2FN/c8-5-1-2-6(9)7(10)4(5)3-11/h1-2H
InChI key:InChIKey=KMFBXAUBFQGZAW-UHFFFAOYSA-N
SMILES:C(#N)C1=C(F)C(Cl)=CC=C1Cl
Synonyms:
  • 3,6-Dichloro-2-fluorobenzonitrile
  • Benzonitrile, 3,6-dichloro-2-fluoro-
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