(4R,5S,6S,7R)-5,6-Dihydroxy-4,7-Bis(Phenylmethyl)-1,3-Dipropyl-1,3-Diazepan-2-One
[CAS# 153181-37-4]

Identification

• Name: (4R,5S,6S,7R)-5,6-Dihydroxy-4,7-Bis(Phenylmethyl)-1,3-Dipropyl-1,3-Diazepan-2-One
• Synonyms: (4R,5S,6S,7R)-4,7-Bis(Benzyl)-5,6-Dihydroxy-1,3-Dipropyl-1,3-Diazepan-2-One; (4R-(4Alpha,5Alpha,6Beta,7Beta))-Hexahydro-5,6-Dihydroxy-1,3-Di-N-Propyl-4,7-Bis(Phenylmethyl)-2H-1,3-Diazepin-2-One; Dmpc Cyclic Urea 39
• Molecular Formula: C₂₅H₃₄N₂O₃
• Molecular Weight: 410.56
• CAS Registry Number: 153181-37-4
• SMILES: [C@@H]1(N(C(=O)N([C@@H]([C@H](O)[C@H]1O)CC2=CC=CC=C2)CCC)CCC)CC3=CC=CC=C3
• InChI: 1S/C25H34N2O3/c1-3-15-26-21(17-19-11-7-5-8-12-19)23(28)24(29)22(27(16-4-2)25(26)30)18-20-13-9-6-10-14-20/h5-14,21-24,28-29H,3-4,15-18H2,1-2H3/t21-,22-,23+,24+/m1/s1
• InChIKey: KVURTRGFRUMHJA-LWSSLDFYSA-N

Properties

• Density: 1.136g/cm³ (Cal.)
• Boiling point: 571.086°C at 760 mmHg (Cal.)
• Flash point: 299.182°C (Cal.)