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CAS 175696-73-8

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3-(1-Pyrrolidinyl)benzonitrile

Description:
3-(1-Pyrrolidinyl)benzonitrile, identified by its CAS number 175696-73-8, is an organic compound characterized by the presence of a pyrrolidine ring attached to a benzonitrile moiety. This compound features a benzene ring substituted with a nitrile group (–C≡N) and a pyrrolidine group (a five-membered nitrogen-containing heterocycle). The molecular structure contributes to its potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to the influence of both the aromatic and nitrogen-containing components on biological activity. The compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its properties, such as melting point, boiling point, and reactivity, can vary based on the specific conditions and purity. As with many nitriles, it may participate in various chemical reactions, including nucleophilic additions and hydrolysis. Safety data should be consulted for handling, as compounds with similar structures can exhibit toxicity or environmental hazards.
Formula:C11H12N2
InChI:InChI=1S/C11H12N2/c12-9-10-4-3-5-11(8-10)13-6-1-2-7-13/h3-5,8H,1-2,6-7H2
InChI key:InChIKey=UMJBSSQWHKPDJF-UHFFFAOYSA-N
SMILES:C(#N)C=1C=C(C=CC1)N2CCCC2
Synonyms:
  • 3-(1-Pyrrolidinyl)benzonitrile
  • 3-(Pyrrolidin-1-yl)benzonitrile
  • 3-Pyrrolidin-1-ylbenzonitrile 95%
  • 3-Pyrrolidinobenzonitrile
  • Benzonitrile, 3-(1-pyrrolidinyl)-
  • N-(3-Cyanophenyl)pyrrolidine
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