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CAS 1242314-99-3

:

4-Chloro-2-fluoro-5-methylbenzeneacetonitrile

Description:
4-Chloro-2-fluoro-5-methylbenzeneacetonitrile, with the CAS number 1242314-99-3, is an organic compound characterized by its aromatic structure, which includes a benzene ring substituted with a chlorine atom, a fluorine atom, and a methyl group, alongside a nitrile functional group. This compound typically exhibits a colorless to pale yellow appearance and is likely to be a solid at room temperature. Its molecular structure suggests it may possess moderate polarity due to the presence of the nitrile group, which can influence its solubility in various solvents. The presence of halogen substituents (chlorine and fluorine) can also impart unique reactivity and stability characteristics, making it of interest in various chemical applications, including pharmaceuticals and agrochemicals. Additionally, the compound may exhibit specific physical properties such as boiling and melting points that are influenced by its molecular interactions. Safety data should be consulted for handling and storage, as halogenated compounds can pose health and environmental risks.
Formula:C9H7ClFN
InChI:InChI=1S/C9H7ClFN/c1-6-4-7(2-3-12)9(11)5-8(6)10/h4-5H,2H2,1H3
InChI key:InChIKey=BAVSNVUPMJZAHC-UHFFFAOYSA-N
SMILES:C(C#N)C1=C(F)C=C(Cl)C(C)=C1
Synonyms:
  • Benzeneacetonitrile, 4-chloro-2-fluoro-5-methyl-
  • 2-(4-Chloro-2-fluoro-5-methylphenyl)acetonitrile
  • 4-Chloro-2-fluoro-5-methylbenzeneacetonitrile
  • (4-Chloro-2-fluoro-5-methylphenyl)acetonitrile
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