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CAS 4640-68-0

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3,4-Dichlorobenzoylacetonitrile

Description:
3,4-Dichlorobenzoylacetonitrile, with the CAS number 4640-68-0, is an organic compound characterized by its structure, which includes a benzoyl group substituted with two chlorine atoms at the 3 and 4 positions, along with an acetonitrile functional group. This compound typically appears as a solid or crystalline substance and is known for its moderate solubility in organic solvents such as acetone and ethanol, while being less soluble in water. It exhibits properties typical of halogenated aromatic compounds, including potential reactivity due to the presence of the electrophilic benzoyl group and the nitrile functional group, which can participate in various chemical reactions. 3,4-Dichlorobenzoylacetonitrile may be utilized in organic synthesis and research applications, particularly in the development of pharmaceuticals or agrochemicals. Safety considerations should be taken into account, as halogenated compounds can pose environmental and health risks. Proper handling and disposal methods are essential when working with this substance in a laboratory setting.
Formula:C9H5Cl2NO
InChI:InChI=1/C9H5Cl2NO/c10-7-2-1-6(5-8(7)11)9(13)3-4-12/h1-2,5H,3H2
SMILES:c1cc(c(cc1C(=O)CC#N)Cl)Cl
Synonyms:
  • 3-(3,4-Dichlorophenyl)-3-Oxopropanenitrile
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