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CAS 1370467-88-1

:

7-Bromo-2,3-dihydro-3-oxo-1H-isoindole-4-carbonitrile

Description:
7-Bromo-2,3-dihydro-3-oxo-1H-isoindole-4-carbonitrile is a chemical compound characterized by its unique structural features, including a bromine atom and a carbonitrile functional group. This compound belongs to the isoindole family, which is known for its bicyclic structure that incorporates a five-membered ring fused to a six-membered ring. The presence of the carbonitrile group indicates that it contains a cyano functional group, which can contribute to its reactivity and potential applications in organic synthesis. The bromine substituent may enhance the compound's electrophilic properties, making it useful in various chemical reactions, including nucleophilic substitutions. Additionally, the keto group (3-oxo) suggests potential for tautomerization and further reactivity. This compound may have applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to the biological activity often associated with isoindole derivatives. However, specific properties such as solubility, melting point, and spectral characteristics would require empirical data for precise characterization.
Formula:C9H5BrN2O
InChI:InChI=1S/C9H5BrN2O/c10-7-2-1-5(3-11)8-6(7)4-12-9(8)13/h1-2H,4H2,(H,12,13)
InChI key:InChIKey=MESWGGOFRUNGLK-UHFFFAOYSA-N
SMILES:C(#N)C1=C2C(=C(Br)C=C1)CNC2=O
Synonyms:
  • 1H-Isoindole-4-carbonitrile, 7-bromo-2,3-dihydro-3-oxo-
  • 7-Bromo-2,3-dihydro-3-oxo-1H-isoindole-4-carbonitrile
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