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CAS 1261438-68-9

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3-Bromo-2-chlorobenzeneacetonitrile

Description:
3-Bromo-2-chlorobenzeneacetonitrile is an organic compound characterized by the presence of both bromine and chlorine substituents on a benzene ring, along with an acetonitrile functional group. This compound typically appears as a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is known for its moderate polarity due to the presence of the nitrile group, which can engage in hydrogen bonding and dipole interactions. The bromine and chlorine atoms contribute to its reactivity, making it a useful intermediate in various organic synthesis reactions, particularly in the development of pharmaceuticals and agrochemicals. The compound is generally stable under standard conditions but may undergo nucleophilic substitution reactions due to the electrophilic nature of the halogenated benzene ring. Safety precautions should be taken when handling this substance, as it may pose health risks, including toxicity and environmental hazards. Proper storage and disposal methods are essential to mitigate any potential risks associated with its use.
Formula:C8H5BrClN
InChI:InChI=1S/C8H5BrClN/c9-7-3-1-2-6(4-5-11)8(7)10/h1-3H,4H2
InChI key:InChIKey=JFZBZXFNUIULCL-UHFFFAOYSA-N
SMILES:C(C#N)C1=C(Cl)C(Br)=CC=C1
Synonyms:
  • 2-(3-Bromo-2-chlorophenyl)acetonitrile
  • Benzeneacetonitrile, 3-bromo-2-chloro-
  • 3-Bromo-2-chlorobenzeneacetonitrile
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