4-(1,1-Dimethylethyl)Phenyl 1-(Aminoiminomethyl)-4-Piperidinecarboxylate
[CAS# 91283-32-8]

Identification

• Name: 4-(1,1-Dimethylethyl)Phenyl 1-(Aminoiminomethyl)-4-Piperidinecarboxylate
• Synonyms: 1-Carbamimidoyl-4-Piperidinecarboxylic Acid (4-Tert-Butylphenyl) Ester; 1-Amidinoisonipecotic Acid (4-Tert-Butylphenyl) Ester; 4-(1,1-Dimethylethyl)Phenyl 1-(Aminoiminomethyl)-4-Piperidinecarboxylate
• Molecular Formula: C₁₇H₂₅N₃O₂
• Molecular Weight: 303.40
• CAS Registry Number: 91283-32-8
• SMILES: C1=CC(=CC=C1OC(C2CCN(CC2)C(=N)N)=O)C(C)(C)C
• InChI: 1S/C17H25N3O2/c1-17(2,3)13-4-6-14(7-5-13)22-15(21)12-8-10-20(11-9-12)16(18)19/h4-7,12H,8-11H2,1-3H3,(H3,18,19)
• InChIKey: PYIOOFVHKMDWER-UHFFFAOYSA-N

Properties

• Density: 1.166g/cm³ (Cal.)
• Boiling point: 425.024°C at 760 mmHg (Cal.)
• Flash point: 210.847°C (Cal.)