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CAS 77668-42-9

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2,3-Dichloro-α-oxobenzeneacetonitrile

Description:
2,3-Dichloro-α-oxobenzeneacetonitrile, with the CAS number 77668-42-9, is an organic compound characterized by its unique structure, which includes a benzene ring substituted with two chlorine atoms and a nitrile functional group. This compound typically appears as a solid or crystalline substance and is known for its potential applications in organic synthesis and as an intermediate in the production of various pharmaceuticals and agrochemicals. The presence of the α-oxoketone moiety contributes to its reactivity, allowing it to participate in various chemical reactions, such as nucleophilic additions. Its dichloro substituents may influence its physical properties, including solubility and melting point, as well as its reactivity profile. Safety data indicates that, like many chlorinated compounds, it should be handled with care due to potential toxicity and environmental concerns. Proper storage and disposal methods are essential to mitigate any risks associated with its use.
Formula:C8H3Cl2NO
InChI:InChI=1S/C8H3Cl2NO/c9-6-3-1-2-5(8(6)10)7(12)4-11/h1-3H
InChI key:InChIKey=FIBBFBXFASKAON-UHFFFAOYSA-N
SMILES:C(C#N)(=O)C1=C(Cl)C(Cl)=CC=C1
Synonyms:
  • 2,3- Dichloro Benzoyl Nitrile
  • 2,3-Dichloro Benzoyl Cyanide
  • 2,3-Dichloro-α-oxobenzeneacetonitrile
  • 2,3-Dichlorobenzoyl nitrile
  • 2,3-Dichlorobenzoylcyanide
  • 2-(2,3-Dichlorophenyl)-2-oxoacetonitrile
  • Benzeneacetonitrile, 2,3-dichloro-α-oxo-
  • 2,3-Dichlorobenzoyl cyanide
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