4-tert-Butylphenyl trans-4-(guanidinomethyl)cyclohexanecarboxylate
[CAS# 81907-78-0]

Identification

• Name: 4-tert-Butylphenyl trans-4-(guanidinomethyl)cyclohexanecarboxylate
• Synonyms: (4-Tert-Butylphenyl) 4-(Guanidinomethyl)Cyclohexane-1-Carboxylate; 4-(Guanidinomethyl)-1-Cyclohexanecarboxylic Acid (4-Tert-Butylphenyl) Ester; 4-(Guanidinomethyl)Cyclohexane-1-Carboxylic Acid (4-Tert-Butylphenyl) Ester
• Molecular Formula: C₁₉H₂₉N₃O₂
• Molecular Weight: 331.46
• CAS Registry Number: 81907-78-0
• SMILES: C1=C(C(C)(C)C)C=CC(=C1)OC(=O)C2CCC(CC2)CN=C(N)N
• InChI: 1S/C19H29N3O2/c1-19(2,3)15-8-10-16(11-9-15)24-17(23)14-6-4-13(5-7-14)12-22-18(20)21/h8-11,13-14H,4-7,12H2,1-3H3,(H4,20,21,22)
• InChIKey: HXLJIJAWKVNQNT-UHFFFAOYSA-N

Properties

• Density: 1.158g/cm³ (Cal.)
• Boiling point: 487.554°C at 760 mmHg (Cal.)
• Flash point: 248.664°C (Cal.)