(4R,5S,6S,7R)-1,3-Bis[(4-Fluorophenyl)Methyl]-5,6-Dihydroxy-4,7-Bis(Phenylmethyl)-1,3-Diazepan-2-One
[CAS# 153182-30-0]

Identification

• Name: (4R,5S,6S,7R)-1,3-Bis[(4-Fluorophenyl)Methyl]-5,6-Dihydroxy-4,7-Bis(Phenylmethyl)-1,3-Diazepan-2-One
• Synonyms: (4R,5S,6S,7R)-4,7-Bis(Benzyl)-1,3-Bis(4-Fluorobenzyl)-5,6-Dihydroxy-1,3-Diazepan-2-One; 2H-1,3-Diazepin-2-One, 1,3-Bis[(4-Fluorophenyl)Methyl]Hexahydro-5,6-Dihydroxy-4,7-Bis(Phenylmethyl)-, (4R,5S,6S,7R)-; Aids-033356
• Molecular Formula: C₃₃H₃₂F₂N₂O₃
• Molecular Weight: 542.62
• CAS Registry Number: 153182-30-0
• SMILES: [C@@H]1(N(C(=O)N([C@@H]([C@H](O)[C@H]1O)CC2=CC=CC=C2)CC3=CC=C(F)C=C3)CC4=CC=C(F)C=C4)CC5=CC=CC=C5
• InChI: 1S/C33H32F2N2O3/c34-27-15-11-25(12-16-27)21-36-29(19-23-7-3-1-4-8-23)31(38)32(39)30(20-24-9-5-2-6-10-24)37(33(36)40)22-26-13-17-28(35)18-14-26/h1-18,29-32,38-39H,19-22H2/t29-,30-,31+,32+/m1/s1
• InChIKey: UWMAWECJLCRQTB-ZRTHHSRSSA-N

Properties

• Density: 1.297g/cm³ (Cal.)
• Boiling point: 704.501°C at 760 mmHg (Cal.)
• Flash point: 379.868°C (Cal.)