1-(1,3-Dihydro-3-oxo-1-isobenzofuranyl)-5-fluoro-2,4(1H,3H)-pyrimidinedione
[CAS# 81820-68-0]

Identification

• Name: 1-(1,3-Dihydro-3-oxo-1-isobenzofuranyl)-5-fluoro-2,4(1H,3H)-pyrimidinedione
• Synonyms: 5-Fluoro-1-(3-Oxo-1H-Isobenzofuran-1-Yl)Pyrimidine-2,4-Dione; 5-Fluoro-1-(3-Keto-1H-Isobenzofuran-1-Yl)Pyrimidine-2,4-Quinone; N(Sub 1)-Phthalidyl-5-Fluorouracil
• Molecular Formula: C₁₂H₇FN₂O₄
• Molecular Weight: 262.20
• CAS Registry Number: 81820-68-0
• SMILES: C2=C1C(OC(=O)C1=CC=C2)N3C(=O)NC(=O)C(=C3)F
• InChI: 1S/C12H7FN2O4/c13-8-5-15(12(18)14-9(8)16)10-6-3-1-2-4-7(6)11(17)19-10/h1-5,10H,(H,14,16,18)
• InChIKey: JADGCGSQDUSAED-UHFFFAOYSA-N

Properties

• Density: 1.627g/cm³ (Cal.)