1-(4-Isocyanatophenyl)-4-methylpiperazine
[CAS# 879896-39-6]

Identification

• Name: 1-(4-Isocyanatophenyl)-4-methylpiperazine
• Synonyms: 4-(4-methylpiperazinyl)benzenisocyanate; PIPERAZINE,1-(4-ISOCYANATOPHENYL)-4-METHYL-
• Molecular Formula: C₁₂H₁₅N₃O
• Molecular Weight: 217.27
• CAS Registry Number: 879896-39-6
• SMILES: CN1CCN(CC1)c2ccc(\N=C=O)cc2
• InChI: 1S/C12H15N3O/c1-14-6-8-15(9-7-14)12-4-2-11(3-5-12)13-10-16/h2-5H,6-9H2,1H3
• InChIKey: HUJDWVCICJKNQJ-UHFFFAOYSA-N

Properties

• Density: 1.135g/cm³ (Cal.)
• Boiling point: 338.635°C at 760 mmHg (Cal.)
• Flash point: 158.601°C (Cal.)
• Refractive index: 1.587 (Cal.)