Product Name

  • Name

    6-Oxo-3H-pyrimidine-4-carboxylic acid

  • EINECS
  • CAS No. 6299-87-2
  • Article Data14
  • CAS DataBase
  • Density 1.63 g/cm3
  • Solubility
  • Melting Point 268-270 °C
  • Formula C5H4N2O3
  • Boiling Point 305.2 °C at 760 mmHg
  • Molecular Weight 140.098
  • Flash Point 138.4 °C
  • Transport Information
  • Appearance
  • Safety 24/25
  • Risk Codes
  • Molecular Structure Molecular Structure of 6299-87-2 (6-Oxo-3H-pyrimidine-4-carboxylic acid)
  • Hazard Symbols IrritantXi
  • Synonyms 4-Pyrimidinecarboxylicacid, 6-hydroxy- (8CI);6-Hydroxypyrimidine-4-carboxylic acid;NSC 45047;
  • PSA 83.31000
  • LogP -0.11960

6-Hydroxy-4-pyrimidinecarboxylic acid Chemical Properties

Molecular Structure of 6-Hydroxy-4-pyrimidinecarboxylic acid (CAS NO.6299-87-2):

IUPAC Name: 4-oxo-1H-pyrimidine-6-carboxylic acid 
Empirical Formula: C5H4N2O3
Molecular Weight: 140.0969
H bond acceptors: 5
H bond donors: 2
Freely Rotating Bonds: 1
Polar Surface Area: 58.97Å2
Index of Refraction: 1.662
Molar Refractivity: 31.69 cm3
Molar Volume: 85.6 cm3
Surface Tension: 71.6 dyne/cm
Density: 1.63 g/cm3
Flash Point: 138.4 °C
Enthalpy of Vaporization: 60.01 kJ/mol
Boiling Point: 305.2 °C at 760 mmHg
Vapour Pressure: 0.000191 mmHg at 25°C
Product Categories: Pyrimidine; pharmacetical; Building Blocks
SMILES: O=C(O)C=1N\C=N/C(=O)C=1
InChI: InChI=1/C5H4N2O3/c8-4-1-3(5(9)10)6-2-7-4/h1-2H,(H,9,10)(H,6,7,8)

6-Hydroxy-4-pyrimidinecarboxylic acid Safety Profile

Hazard Codes: IrritantXi

6-Hydroxy-4-pyrimidinecarboxylic acid Specification

  6-Hydroxy-4-pyrimidinecarboxylic acid , with CAS number of 6299-87-2, can be called 4-pyrimidinecarboxylic acid, 6-hydroxy- ; 1,6-Dihydro-6-oxo-4-pyrimidinecarboxylic acid ; Pyrimidin-6-ol-4-carboxylic acid .

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