4-{2-[(4-Methyl-1-piperazinyl)methyl]benzoyl}benzonitrile
[CAS# 898782-86-0]

Identification

• Name: 4-{2-[(4-Methyl-1-piperazinyl)methyl]benzoyl}benzonitrile
• Synonyms: 4'-cyano-2-(4-methylpiperazinomethyl) benzophenone
• Molecular Formula: C₂₀H₂₁N₃O
• Molecular Weight: 319.40
• CAS Registry Number: 898782-86-0
• SMILES: N#Cc1ccc(cc1)C(=O)c3ccccc3CN2CCN(C)CC2
• InChI: 1S/C20H21N3O/c1-22-10-12-23(13-11-22)15-18-4-2-3-5-19(18)20(24)17-8-6-16(14-21)7-9-17/h2-9H,10-13,15H2,1H3
• InChIKey: MVRWHBBQEMSUNV-UHFFFAOYSA-N

Properties

• Density: 1.206g/cm³ (Cal.)
• Boiling point: 507.98°C at 760 mmHg (Cal.)
• Flash point: 261.017°C (Cal.)
• Refractive index: 1.63 (Cal.)