ChemSpider 2D Image | 3-Bromo(4,5-~2~H_2_)-1H-pyrazole | C3HD2BrN2

3-Bromo(4,5-2H2)-1H-pyrazole

  • Molecular FormulaC3HD2BrN2
  • Average mass148.986 Da
  • Monoisotopic mass147.960510 Da
  • ChemSpider ID111333961

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Pyrazole-4,5-d2, 3-bromo- [ACD/Index Name]
3-Brom(4,5-2H2)-1H-pyrazol [German] [ACD/IUPAC Name]
3-Bromo(4,5-2H2)-1H-pyrazole [ACD/IUPAC Name]
3-Bromo(4,5-2H2)-1H-pyrazole [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 264.1±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.2±3.0 kJ/mol
Flash Point: 113.5±19.8 °C
Index of Refraction: 1.602
Molar Refractivity: 26.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.39
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 7.22
ACD/KOC (pH 5.5): 143.34
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 7.22
ACD/KOC (pH 7.4): 143.30
Polar Surface Area: 29 Å2
Polarizability: 10.5±0.5 10-24cm3
Surface Tension: 56.5±3.0 dyne/cm
Molar Volume: 77.2±3.0 cm3

Click to predict properties on the Chemicalize site


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