Ethyl 4-({3-[({[(2-methyl-2-propanyl)oxy]carbonyl}amino)methyl]phenyl}amino)benzoate
[CAS# 936497-81-3]

Identification

• Name: Ethyl 4-({3-[({[(2-methyl-2-propanyl)oxy]carbonyl}amino)methyl]phenyl}amino)benzoate
• Synonyms: (carbethoxyphenyl)amine; 4-[3-(tert-Butoxycarbonylamino-methyl)-phenylamino]-benzoic acid ethyl ester; N-(3-Boc-aminomethylphenyl)-N-4-
• Molecular Formula: C₂₁H₂₆N₂O₄
• Molecular Weight: 370.44
• CAS Registry Number: 936497-81-3
• SMILES: CCOC(=O)c1ccc(cc1)Nc2cc(ccc2)CNC(=O)OC(C)(C)C
• InChI: 1S/C21H26N2O4/c1-5-26-19(24)16-9-11-17(12-10-16)23-18-8-6-7-15(13-18)14-22-20(25)27-21(2,3)4/h6-13,23H,5,14H2,1-4H3,(H,22,25)
• InChIKey: QENJSZYGBHHRGB-UHFFFAOYSA-N

Properties

• Density: 1.154g/cm³ (Cal.)
• Boiling point: 530.592°C at 760 mmHg (Cal.)
• Flash point: 274.692°C (Cal.)
• Refractive index: 1.57 (Cal.)