3-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)-3-(2-Nitrophenyl)Propanoic Acid
[CAS# 206537-28-2]

Identification

• Name: 3-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)-3-(2-Nitrophenyl)Propanoic Acid
• Synonyms: 3-(N-Boc)amino-3-(2-nitro-phenyl)-propionic acid; 3-[(tert-butoxycarbonyl)amino]-3-(2-nitrophenyl)propanoic acid
• Molecular Formula: C₁₄H₁₈N₂O₆
• Molecular Weight: 310.30
• CAS Registry Number: 206537-28-2
• SMILES: [O-][N+](=O)c1ccccc1C(NC(=O)OC(C)(C)C)CC(=O)O
• InChI: 1S/C14H18N2O6/c1-14(2,3)22-13(19)15-10(8-12(17)18)9-6-4-5-7-11(9)16(20)21/h4-7,10H,8H2,1-3H3,(H,15,19)(H,17,18)
• InChIKey: SAVFDQXYVJSWEN-UHFFFAOYSA-N

Properties

• Density: 1.288g/cm³ (Cal.)
• Boiling point: 512.776°C at 760 mmHg (Cal.)
• Flash point: 263.918°C (Cal.)
• Refractive index: 1.553 (Cal.)