N(alpha)-((2-Phenylethyl)Phenoxyphosphoryl)Alanylproline
[CAS# 97280-48-3]

Identification

• Name: N(alpha)-((2-Phenylethyl)Phenoxyphosphoryl)Alanylproline
• Synonyms: (2S)-1-[(2S)-1-Oxo-2-[(Phenoxy-(2-Phenylethyl)Phosphoryl)Amino]Propyl]-2-Pyrrolidinecarboxylic Acid; (2S)-1-[(2S)-2-[(Phenoxy-(2-Phenylethyl)Phosphoryl)Amino]Propanoyl]Proline; L-Proline, 1-(N-(Phenoxy(2-Phenylethyl)Phosphinyl)-L-Alanyl)-
• Molecular Formula: C₂₂H₂₇N₂O₅P
• Molecular Weight: 430.44
• CAS Registry Number: 97280-48-3
• SMILES: [C@@H]1(N(CCC1)C(=O)[C@@H](N[P](OC2=CC=CC=C2)(=O)CCC3=CC=CC=C3)C)C(O)=O
• InChI: 1S/C22H27N2O5P/c1-17(21(25)24-15-8-13-20(24)22(26)27)23-30(28,29-19-11-6-3-7-12-19)16-14-18-9-4-2-5-10-18/h2-7,9-12,17,20H,8,13-16H2,1H3,(H,23,28)(H,26,27)/t17-,20-,30?/m0/s1
• InChIKey: PJJLAARCNXDCQT-NTUPXMOSSA-N

Properties

• Density: 1.284g/cm³ (Cal.)
• Boiling point: 635.185°C at 760 mmHg (Cal.)
• Flash point: 337.948°C (Cal.)