1-[(Benzyloxy)carbonyl]-L-prolyl-N⁵-carbamoyl-N-(4-nitrophenyl)-L-ornithinamide
[CAS# 83575-44-4]

Identification

• Name: 1-[(Benzyloxy)carbonyl]-L-prolyl-N⁵-carbamoyl-N-(4-nitrophenyl)-L-ornithinamide
• Synonyms: 1-(benzyloxycarbonyl)-L-prolyl-N5-carbamoyl-N-(4-nitrophenyl)-L-ornithinamide
• Molecular Formula: C₂₅H₃₀N₆O₇
• Molecular Weight: 526.54
• CAS Registry Number: 83575-44-4
• EINECS: 280-494-4
• SMILES: O=C(N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(cc1)[N+]([O-])=O)[C@@H]3CCCN3C(=O)OCc2ccccc2
• InChI: 1S/C25H30N6O7/c26-24(34)27-14-4-8-20(22(32)28-18-10-12-19(13-11-18)31(36)37)29-23(33)21-9-5-15-30(21)25(35)38-16-17-6-2-1-3-7-17/h1-3,6-7,10-13,20-21H,4-5,8-9,14-16H2,(H,28,32)(H,29,33)(H3,26,27,34)/t20-,21-/m0/s1
• InChIKey: PNQFRPZBIORRRX-SFTDATJTSA-N

Properties

• Density: 1.373g/cm³ (Cal.)
• Boiling point: 847.351°C at 760 mmHg (Cal.)
• Flash point: 466.261°C (Cal.)