ChemSpider 2D Image | 2-(~2~H_3_)Pyrimidinol | C4HD3N2O

2-(2H3)Pyrimidinol

  • Molecular FormulaC4HD3N2O
  • Average mass99.106 Da
  • Monoisotopic mass99.051193 Da
  • ChemSpider ID111328554

  • Non-standard isotope - Non-standard isotope

More details:

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

2-(2H3)Pyrimidinol [German] [ACD/IUPAC Name]
2-(2H3)Pyrimidinol [ACD/IUPAC Name]
2-(2H3)Pyrimidinol [French] [ACD/IUPAC Name]
2-Pyrimidin-d3-ol [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 309.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.2±3.0 kJ/mol
Flash Point: 140.8±23.2 °C
Index of Refraction: 1.568
Molar Refractivity: 24.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.76
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.01
ACD/LogD (pH 7.4): -1.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.87
Polar Surface Area: 46 Å2
Polarizability: 9.6±0.5 10-24cm3
Surface Tension: 64.5±3.0 dyne/cm
Molar Volume: 74.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement