ChemSpider 2D Image | 3,5-Dibromo-1H-pyrazole-4-carboxylic acid | C4H2Br2N2O2

3,5-Dibromo-1H-pyrazole-4-carboxylic acid

  • Molecular FormulaC4H2Br2N2O2
  • Average mass269.879 Da
  • Monoisotopic mass267.848297 Da
  • ChemSpider ID45663364

More details:

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

1H-Pyrazole-4-carboxylic acid, 3,5-dibromo- [ACD/Index Name]
3,5-Dibrom-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
3,5-Dibromo-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
98026-81-4 [RN]
Acide 3,5-dibromo-1H-pyrazole-4-carboxylique [French] [ACD/IUPAC Name]
MFCD00462185

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

Density: 2.5±0.1 g/cm3
Boiling Point: 465.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 235.2±28.7 °C
Index of Refraction: 1.704
Molar Refractivity: 41.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): -1.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability: 16.3±0.5 10-24cm3
Surface Tension: 87.8±3.0 dyne/cm
Molar Volume: 105.9±3.0 cm3

Click to predict properties on the Chemicalize site


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