[(2R,3S,5R)-5-(5-Bromo-2,4-Dioxopyrimidin-1-Yl)-2-(Octanoyloxymethyl)Oxolan-3-Yl] Octanoate
[CAS# 154653-67-5]

Identification

• Name: [(2R,3S,5R)-5-(5-Bromo-2,4-Dioxopyrimidin-1-Yl)-2-(Octanoyloxymethyl)Oxolan-3-Yl] Octanoate
• Synonyms: [(2R,3S,5R)-5-(5-Bromo-2,4-Dioxo-Pyrimidin-1-Yl)-2-(Octanoyloxymethyl)Tetrahydrofuran-3-Yl] Octanoate; Octanoic Acid [(2R,3S,5R)-5-(5-Bromo-2,4-Dioxo-1-Pyrimidinyl)-2-(1-Oxooctoxymethyl)-3-Tetrahydrofuranyl] Ester; Caprylic Acid [(2R,3S,5R)-5-(5-Bromo-2,4-Diketo-Pyrimidin-1-Yl)-2-(Caprylyloxymethyl)Tetrahydrofuran-3-Yl] Ester
• Molecular Formula: C₂₅H₃₉BrN₂O₇
• Molecular Weight: 559.50
• CAS Registry Number: 154653-67-5
• SMILES: [C@H]1(O[C@@H]([C@@H](OC(=O)CCCCCCC)C1)COC(=O)CCCCCCC)N2C(=O)NC(=O)C(=C2)Br
• InChI: 1S/C25H39BrN2O7/c1-3-5-7-9-11-13-22(29)33-17-20-19(35-23(30)14-12-10-8-6-4-2)15-21(34-20)28-16-18(26)24(31)27-25(28)32/h16,19-21H,3-15,17H2,1-2H3,(H,27,31,32)/t19-,20+,21+/m0/s1
• InChIKey: GDRPJKGKAGJBGR-PWRODBHTSA-N

Properties

• Density: 1.306g/cm³ (Cal.)