ChemSpider 2D Image | 6-Hydroxy-2-(trifluoromethyl)-4-pyrimidinecarboxylic acid | C6H3F3N2O3

6-Hydroxy-2-(trifluoromethyl)-4-pyrimidinecarboxylic acid

  • Molecular FormulaC6H3F3N2O3
  • Average mass208.095 Da
  • Monoisotopic mass208.009583 Da
  • ChemSpider ID29365232

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,6-Dihydro-6-oxo-2-(trifluoromethyl)-4-pyrimidinecarboxylic acid
4-Pyrimidinecarboxylic acid, 6-hydroxy-2-(trifluoromethyl)- [ACD/Index Name]
657-54-5 [RN]
6-Hydroxy-2-(trifluormethyl)-4-pyrimidincarbonsäure [German] [ACD/IUPAC Name]
6-Hydroxy-2-(trifluoromethyl)-4-pyrimidinecarboxylic acid [ACD/IUPAC Name]
Acide 6-hydroxy-2-(trifluorométhyl)-4-pyrimidinecarboxylique [French] [ACD/IUPAC Name]
6-Hydroxy-2-(trifluoromethyl)pyrimidine-4-carboxylic acid
6-oxo-2-trifluoromethyl-1,6-dihydro-pyrimidine-4-carboxylic acid
MFCD24484373

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.7±0.1 g/cm3
Boiling Point: 302.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.3±3.0 kJ/mol
Flash Point: 136.8±27.9 °C
Index of Refraction: 1.514
Molar Refractivity: 36.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.01
ACD/LogD (pH 5.5): -2.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 83 Å2
Polarizability: 14.4±0.5 10-24cm3
Surface Tension: 56.5±3.0 dyne/cm
Molar Volume: 120.4±3.0 cm3

Click to predict properties on the Chemicalize site


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