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CAS 166438-80-8

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4-(4-METHYL-1,4-DIAZEPAN-1-YL)BENZONITRILE 97

Description:
4-(4-Methyl-1,4-diazepan-1-yl)benzonitrile, with the CAS number 166438-80-8, is a chemical compound characterized by its structure, which includes a benzene ring substituted with a nitrile group and a 1,4-diazepane moiety. This compound typically exhibits properties associated with both aromatic and aliphatic systems, including potential solubility in organic solvents. The presence of the nitrile group suggests that it may participate in nucleophilic reactions, while the diazepane ring can influence its pharmacological properties, potentially acting as a ligand in biological systems. The methyl group on the diazepane can affect steric hindrance and electronic distribution, which may play a role in its reactivity and interaction with biological targets. As with many organic compounds, its stability, reactivity, and potential applications can vary based on environmental conditions and the presence of other functional groups. Safety data and handling precautions should be consulted, as with any chemical substance, to ensure proper usage and risk management.
Formula:C13H17N3
InChI:InChI=1/C13H17N3/c1-15-7-2-8-16(10-9-15)13-5-3-12(11-14)4-6-13/h3-6H,2,7-10H2,1H3
SMILES:CN1CCCN(CC1)c1ccc(cc1)C#N
Synonyms:
  • 4-(4-Methylperhydro-1,4-Diazepin-1-Yl)Benzonitrile
  • 4-(4-Methyl-1,4-Diazepan-1-Yl)Benzonitrile
  • 4-(4-Methyl-1,4-diazepan-1-yl)benzonitrile 97%
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