[(2R,3S,5R)-2-(Acetyloxymethyl)-5-[5-Fluoro-3-(3-Methylbenzoyl)-2,4-Dioxopyrimidin-1-Yl]Oxolan-3-Yl] Acetate
[CAS# 74596-17-1]

Identification

• Name: [(2R,3S,5R)-2-(Acetyloxymethyl)-5-[5-Fluoro-3-(3-Methylbenzoyl)-2,4-Dioxopyrimidin-1-Yl]Oxolan-3-Yl] Acetate
• Synonyms: [(2R,3S,5R)-2-(Acetoxymethyl)-5-[5-Fluoro-3-(3-Methylbenzoyl)-2,4-Dioxo-Pyrimidin-1-Yl]Tetrahydrofuran-3-Yl] Acetate; Acetic Acid [(2R,3S,5R)-2-(Acetoxymethyl)-5-[5-Fluoro-3-[(3-Methylphenyl)-Oxomethyl]-2,4-Dioxo-1-Pyrimidinyl]-3-Tetrahydrofuranyl] Ester; Acetic Acid [(2R,3S,5R)-2-(Acetoxymethyl)-5-[5-Fluoro-2,4-Diketo-3-(3-Methylbenzoyl)Pyrimidin-1-Yl]Tetrahydrofuran-3-Yl] Ester
• Molecular Formula: C₂₁H₂₁FN₂O₈
• Molecular Weight: 448.40
• CAS Registry Number: 74596-17-1
• SMILES: [C@H]1(O[C@@H]([C@@H](OC(=O)C)C1)COC(=O)C)N2C(=O)N(C(=O)C(=C2)F)C(=O)C3=CC(=CC=C3)C
• InChI: 1S/C21H21FN2O8/c1-11-5-4-6-14(7-11)19(27)24-20(28)15(22)9-23(21(24)29)18-8-16(31-13(3)26)17(32-18)10-30-12(2)25/h4-7,9,16-18H,8,10H2,1-3H3/t16-,17+,18+/m0/s1
• InChIKey: IKNZXGXQOQHHJA-RCCFBDPRSA-N

Properties

• Density: 1.434g/cm³ (Cal.)
• Boiling point: 555.761°C at 760 mmHg (Cal.)
• Flash point: 289.914°C (Cal.)