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CAS 62538-21-0

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4-Chloro-α-formylbenzeneacetonitrile

Description:
4-Chloro-α-formylbenzeneacetonitrile, with the CAS number 62538-21-0, is an organic compound characterized by its functional groups, which include a chloro substituent, a formyl group, and a nitrile group. This compound typically appears as a crystalline solid and is soluble in organic solvents. The presence of the chloro group introduces a degree of reactivity, making it a useful intermediate in organic synthesis, particularly in the preparation of various pharmaceuticals and agrochemicals. The formyl group contributes to its reactivity, allowing for further transformations such as condensation reactions. Additionally, the nitrile group can participate in nucleophilic addition reactions, expanding its utility in synthetic chemistry. The compound's structure suggests potential applications in materials science and medicinal chemistry, where derivatives may exhibit interesting biological activities. As with many organic compounds, handling should be done with care, considering potential toxicity and environmental impact. Proper safety protocols should be followed when working with this substance in a laboratory setting.
Formula:C9H6ClNO
InChI:InChI=1S/C9H6ClNO/c10-9-3-1-7(2-4-9)8(5-11)6-12/h1-4,6,8H
InChI key:InChIKey=DAEXXSXAEMFPHQ-UHFFFAOYSA-N
SMILES:C(C#N)(C=O)C1=CC=C(Cl)C=C1
Synonyms:
  • 2-(4-Chloro-phenyl)-3-oxo-propionitrile
  • 2-(4-Chlorophenyl)-2-formylacetonitrile
  • 2-(4-Chlorophenyl)-3-oxopropanenitrile
  • 4-Chloro-α-formylbenzeneacetonitrile
  • Acetaldehyde, (p-chlorophenyl)cyano-
  • Benzeneacetonitrile, 4-chloro-α-formyl-
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