4-Carbamoyl-N-{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-L-Phenylalanine
[CAS# 205126-71-2]

Identification

• Name: 4-Carbamoyl-N-{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-L-Phenylalanine
• Synonyms: (2S)-2-[(tert-butoxycarbonyl)amino]-3-(4-carbamoylphenyl)propanoic acid; Boc-L-4-Carbamoylphe; Boc-L-4-Carbamoylphenylalanine
• Molecular Formula: C₁₅H₂₀N₂O₅
• Molecular Weight: 308.33
• CAS Registry Number: 205126-71-2
• SMILES: O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ccc(cc1)C(=O)N
• InChI: 1S/C15H20N2O5/c1-15(2,3)22-14(21)17-11(13(19)20)8-9-4-6-10(7-5-9)12(16)18/h4-7,11H,8H2,1-3H3,(H2,16,18)(H,17,21)(H,19,20)/t11-/m0/s1
• InChIKey: OJOCXVKXBATIDB-NSHDSACASA-N

Properties

• Density: 1.247g/cm³ (Cal.)
• Boiling point: 534.083°C at 760 mmHg (Cal.)
• Flash point: 276.804°C (Cal.)
• Refractive index: 1.555 (Cal.)