Methyl 3-Amino-4-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)Benzoate
[CAS 327046-67-3]

Identification

• Name: Methyl 3-Amino-4-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)Benzoate
• Synonyms: Benzoic acid, 3-amino-4-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester; Methyl 3-amino-4-((tert-butoxycarbonyl)amino)benzoate; MFCD09701212
• Molecular Formula: C₁₃H₁₈N₂O₄
• Molecular Weight: 266.29
• CAS Registry Number: 327046-67-3
• SMILES: COC(=O)c1ccc(NC(=O)OC(C)(C)C)c(N)c1
• InChI: 1S/C13H18N2O4/c1-13(2,3)19-12(17)15-10-6-5-8(7-9(10)14)11(16)18-4/h5-7H,14H2,1-4H3,(H,15,17)
• InChIKey: WZDQSJQQRFYYPK-UHFFFAOYSA-N

Properties

• Density: 1.218g/cm³ (Cal.)
• Boiling point: 364.031°C at 760 mmHg (Cal.)
• Flash point: 173.96°C (Cal.)
• Refractive index: 1.574 (Cal.)