5-Fluoro-2,4(1H,3H)-Pyrimidinedione
[CAS 191047-65-1]

Identification

• Name: 5-Fluoro-2,4(1H,3H)-Pyrimidinedione
• Synonyms: "5-fluoro-1H-pyrimidine-2,4-dione"; "5-fluoro-2,4(1H,3H)-pyrimidinedione"; 2,4-DIHYDROXY-5-FLUOROPYRIMIDINE
• Molecular Formula: C₄H₃FN₂O₂
• Molecular Weight: 130.08
• CAS Registry Number: 191047-65-1
• SMILES: C1=C(C(=O)NC(=O)N1)F
• InChI: 1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
• InChIKey: GHASVSINZRGABV-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Melting point: 280°C (Expl.)
• Refractive index: 1.523 (Cal.)
• solubility: Soluble to 100 mM in DMSO and to 10 mM in ethanol

Safety Data

• Safety Code: S53;S45
• Risk Code: R61;R22;R48/22;R68
• Hazard Symbol: T
• Transport Information: UN2811
• Safety Description: R20/21,R25,R51/53

References

• (1): Fang Yao, Liqun Xu, Baoping Lin and Guo-Dong Fu. Preparation and applications of functional nanofibers based on the combination of electrospinning, controlled radical polymerization and ‘Click Chemistry’, Nanoscale, 2010, 2, 1348.