ChemSpider 2D Image | 4-Bromo-2-(~2~H_3_)methyl-1H-imidazole | C4H2D3BrN2

4-Bromo-2-(2H3)methyl-1H-imidazole

  • Molecular FormulaC4H2D3BrN2
  • Average mass164.018 Da
  • Monoisotopic mass162.982437 Da
  • ChemSpider ID53604645

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Imidazole, 4-bromo-2-(methyl-d3)- [ACD/Index Name]
4-Brom-2-(2H3)methyl-1H-imidazol [German] [ACD/IUPAC Name]
4-Bromo-2-(2H3)methyl-1H-imidazole [ACD/IUPAC Name]
4-Bromo-2-(2H3)méthyl-1H-imidazole [French] [ACD/IUPAC Name]
4-Bromo-2-(methyl-d3)-imidazole

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

Density: 1.7±0.1 g/cm3
Boiling Point: 333.9±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.4±3.0 kJ/mol
Flash Point: 155.7±20.4 °C
Index of Refraction: 1.584
Molar Refractivity: 31.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.80
ACD/LogD (pH 5.5): 0.83
ACD/BCF (pH 5.5): 2.18
ACD/KOC (pH 5.5): 51.77
ACD/LogD (pH 7.4): 1.07
ACD/BCF (pH 7.4): 3.83
ACD/KOC (pH 7.4): 90.75
Polar Surface Area: 29 Å2
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 50.6±3.0 dyne/cm
Molar Volume: 93.4±3.0 cm3

Click to predict properties on the Chemicalize site


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