ChemSpider 2D Image | 5-Bromo-2-(~2~H_2_)pyrimidinamine | C4H2D2BrN3

5-Bromo-2-(2H2)pyrimidinamine

  • Molecular FormulaC4H2D2BrN3
  • Average mass176.011 Da
  • Monoisotopic mass174.971405 Da
  • ChemSpider ID111328797

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Pyrimidin-4,6-d2-amine, 5-bromo- [ACD/Index Name]
5-Brom-2-(2H2)pyrimidinamin [German] [ACD/IUPAC Name]
5-Bromo-2-(2H2)pyrimidinamine [ACD/IUPAC Name]
5-Bromo-2-(2H2)pyrimidinamine [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 340.7±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.4±3.0 kJ/mol
Flash Point: 159.9±25.7 °C
Index of Refraction: 1.649
Molar Refractivity: 34.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.78
ACD/LogD (pH 5.5): 0.95
ACD/BCF (pH 5.5): 3.09
ACD/KOC (pH 5.5): 78.09
ACD/LogD (pH 7.4): 0.95
ACD/BCF (pH 7.4): 3.09
ACD/KOC (pH 7.4): 78.11
Polar Surface Area: 52 Å2
Polarizability: 13.6±0.5 10-24cm3
Surface Tension: 69.0±3.0 dyne/cm
Molar Volume: 94.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement