N-[(Phenylmethoxy)Carbonyl]-L-Alanyl-L-Phenylalanine
[CAS# 2768-53-8]

Identification

• Name: N-[(Phenylmethoxy)Carbonyl]-L-Alanyl-L-Phenylalanine
• Synonyms: 2-[[1-Oxo-2-[[Oxo-(Phenylmethoxy)Methyl]Amino]Propyl]Amino]-3-Phenylpropanoic Acid; 2-[2-(Benzyloxycarbonylamino)Propanoylamino]-3-Phenyl-Propionic Acid; Nsc87854
• Molecular Formula: C₂₀H₂₂N₂O₅
• Molecular Weight: 370.40
• CAS Registry Number: 2768-53-8
• EINECS: 220-454-5
• SMILES: C1=CC=CC=C1CC(NC(C(NC(OCC2=CC=CC=C2)=O)C)=O)C(O)=O
• InChI: 1S/C20H22N2O5/c1-14(21-20(26)27-13-16-10-6-3-7-11-16)18(23)22-17(19(24)25)12-15-8-4-2-5-9-15/h2-11,14,17H,12-13H2,1H3,(H,21,26)(H,22,23)(H,24,25)
• InChIKey: BVNXQVWGWUHKMK-UHFFFAOYSA-N

Properties

• Density: 1.253g/cm³ (Cal.)
• Boiling point: 643.668°C at 760 mmHg (Cal.)
• Flash point: 343.078°C (Cal.)