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CAS 874285-20-8

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2-Chloro-3-fluorobenzeneacetonitrile

Description:
2-Chloro-3-fluorobenzeneacetonitrile, with the CAS number 874285-20-8, is an organic compound characterized by its aromatic structure and the presence of both chlorine and fluorine substituents on the benzene ring. This compound features a nitrile functional group (-C≡N) attached to an acetic acid derivative, which contributes to its reactivity and potential applications in organic synthesis. The presence of halogens, specifically chlorine and fluorine, often enhances the compound's lipophilicity and can influence its biological activity, making it of interest in pharmaceutical research. 2-Chloro-3-fluorobenzeneacetonitrile is typically a colorless to pale yellow liquid or solid, depending on its purity and specific conditions. It is important to handle this compound with care, as nitriles can be toxic and may pose environmental hazards. Its unique structure allows for various chemical transformations, making it a valuable intermediate in the synthesis of more complex molecules in medicinal chemistry and agrochemicals.
Formula:C8H5ClFN
InChI:InChI=1S/C8H5ClFN/c9-8-6(4-5-11)2-1-3-7(8)10/h1-3H,4H2
InChI key:InChIKey=SNWZECDZPCGLBA-UHFFFAOYSA-N
SMILES:C(C#N)C1=C(Cl)C(F)=CC=C1
Synonyms:
  • 2-Chloro-3-fluorobenzeneacetonitrile
  • 2-(2-Chloro-3-fluorophenyl)acetonitrile
  • Benzeneacetonitrile, 2-chloro-3-fluoro-
  • (2-Chloro-3-fluorophenyl)acetonitrile
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