Product Name

  • Name

    4(1H)-Pyrimidinone, 5-fluoro-6-hydroxy-2-methyl- (9CI)

  • EINECS
  • CAS No. 1598-63-6
  • Density 1.59 g/cm3
  • Solubility
  • Melting Point >310℃
  • Formula C5H5FN2O2
  • Boiling Point 267.7 °C at 760 mmHg
  • Molecular Weight 144.1038032
  • Flash Point 115.7 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 1598-63-6 (4(1H)-Pyrimidinone, 5-fluoro-6-hydroxy-2-methyl- (9CI))
  • Hazard Symbols
  • Synonyms 4(1H)-Pyrimidinone,5-fluoro-6-hydroxy-2-methyl- (9CI);4,6-Pyrimidinediol, 5-fluoro-2-methyl-(6CI,8CI);5-Fluoro-2-methylpyrimidine-4,6-diol;5-Fluoro-4,6-dihydroxy-2-methylpyrimidine;NSC 33038;
  • PSA 66.24000
  • LogP 0.33530

4(3H)-Pyrimidinone,5-fluoro-6-hydroxy-2-methyl- Specification

The 4(3H)-Pyrimidinone,5-fluoro-6-hydroxy-2-methyl- is an organic compound with the formula C5H5FN2O2. The IUPAC name of this chemical is 5-Fluoro-4-hydroxy-2-methyl-1H-pyrimidin-6-one. With the CAS registry number 1598-63-6, it is also named as 4,6-Pyrimidinediol, 5-fluoro-2-methyl-. The product's category is Pyrimidine. Besides, its molecular weight is 144.1038032.

Physical properties about 4(3H)-Pyrimidinone,5-fluoro-6-hydroxy-2-methyl- are: (1)ACD/LogP: -1.08; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 41.9 Å2; (10)Index of Refraction: 1.59; (11)Molar Refractivity: 30.53 cm3; (12)Molar Volume: 90.3 cm3; (13)Polarizability: 12.1×10-24 cm3; (14)Surface Tension: 46.6 dyne/cm; (15)Density: 1.59 g/cm3; (16)Flash Point: 115.7 °C; (17)Enthalpy of Vaporization: 52.62 kJ/mol; (18)Boiling Point: 267.7 °C at 760 mmHg; (19)Vapour Pressure: 0.00486 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C5H5FN2O2/c1-2-7-4(9)3(6)5(10)8-2/h1H3,(H2,7,8,9,10)
(2)InChIKey: REAPDCOFEGTTLS-UHFFFAOYAI
(3)Std. InChI: InChI=1S/C5H5FN2O2/c1-2-7-4(9)3(6)5(10)8-2/h1H3,(H2,7,8,9,10)
(4)Std. InChIKey: REAPDCOFEGTTLS-UHFFFAOYSA-N

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