2-Methyl-2-propanyl 4-(3-cyanophenyl)-1-piperazinecarboxylate
[CAS# 807624-20-0]

Identification

• Name: 2-Methyl-2-propanyl 4-(3-cyanophenyl)-1-piperazinecarboxylate
• Synonyms: 1-Piperazinecarboxylic acid, 4-(3-cyanophenyl)-, 1,1-dimethylethyl ester; 2-Methyl-2-propanyl 4-(3-cyanophenyl)-1-piperazinecarboxylate; 2-Methyl-2-propanyl-4-(3-cyanphenyl)-1-piperazincarboxylat
• Molecular Formula: C₁₆H₂₁N₃O₂
• Molecular Weight: 287.36
• CAS Registry Number: 807624-20-0
• SMILES: CC(C)(C)OC(=O)N1CCN(CC1)c2cccc(c2)C#N
• InChI: 1S/C16H21N3O2/c1-16(2,3)21-15(20)19-9-7-18(8-10-19)14-6-4-5-13(11-14)12-17/h4-6,11H,7-10H2,1-3H3
• InChIKey: CAHGMTOVXFIRAF-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Melting point: 124-126°C (Expl.)
• Boiling point: 432.2±40.0°C at 760 mmHg (Cal.)
• Flash point: 215.2±27.3°C (Cal.)
• Refractive index: 1.571 (Cal.)

Safety Data

• Safety Description: IRRITANT