ChemSpider 2D Image | 4,5-Dibromo-2-hydroxybenzonitrile | C7H3Br2NO

4,5-Dibromo-2-hydroxybenzonitrile

  • Molecular FormulaC7H3Br2NO
  • Average mass276.913 Da
  • Monoisotopic mass274.858124 Da
  • ChemSpider ID61857220

More details:

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

4,5-Dibrom-2-hydroxybenzonitril [German] [ACD/IUPAC Name]
4,5-Dibromo-2-hydroxybenzonitrile [ACD/IUPAC Name]
4,5-Dibromo-2-hydroxybenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4,5-dibromo-2-hydroxy- [ACD/Index Name]
2091692-99-6 [RN]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 325.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.0±3.0 kJ/mol
Flash Point: 150.7±27.9 °C
Index of Refraction: 1.711
Molar Refractivity: 48.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 95.40
ACD/KOC (pH 5.5): 780.86
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 2.96
ACD/KOC (pH 7.4): 24.22
Polar Surface Area: 44 Å2
Polarizability: 19.1±0.5 10-24cm3
Surface Tension: 80.9±5.0 dyne/cm
Molar Volume: 123.5±5.0 cm3

Click to predict properties on the Chemicalize site


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