3-[(4-Methyl-1-piperazinyl)methyl]benzonitrile
[CAS# 859850-90-1]

Identification

• Name: 3-[(4-Methyl-1-piperazinyl)methyl]benzonitrile
• Synonyms: 3-[(4-methylpiperazinyl)methyl]benzenecarbonitrile; BENZONITRILE,3-[(4-METHYL-1-PIPERAZINYL)METHYL]-
• Molecular Formula: C₁₃H₁₇N₃
• Molecular Weight: 215.29
• CAS Registry Number: 859850-90-1
• SMILES: N#Cc1cc(ccc1)CN2CCN(CC2)C
• InChI: 1S/C13H17N3/c1-15-5-7-16(8-6-15)11-13-4-2-3-12(9-13)10-14/h2-4,9H,5-8,11H2,1H3
• InChIKey: NNYDAONDPGWBRI-UHFFFAOYSA-N

Properties

• Density: 1.117g/cm³ (Cal.)
• Boiling point: 334.196°C at 760 mmHg (Cal.)
• Flash point: 139.395°C (Cal.)
• Refractive index: 1.587 (Cal.)