ChemSpider 2D Image | 3,5-Dibromo-4-(~2~H)hydroxybenzonitrile | C7H2DBr2NO

3,5-Dibromo-4-(2H)hydroxybenzonitrile

  • Molecular FormulaC7H2DBr2NO
  • Average mass277.919 Da
  • Monoisotopic mass275.864410 Da
  • ChemSpider ID95677930

  • Non-standard isotope - Non-standard isotope

More details:

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

3,5-Dibrom-4-(2H)hydroxybenzonitril [German] [ACD/IUPAC Name]
3,5-Dibromo-4-(2H)hydroxybenzonitrile [ACD/IUPAC Name]
3,5-Dibromo-4-(2H)hydroxybenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 3,5-dibromo-4-(hydroxy-d)- [ACD/Index Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 265.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.4±3.0 kJ/mol
Flash Point: 114.4±27.3 °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: 2.95
ACD/LogD (pH 5.5): 2.35
ACD/BCF (pH 5.5): 22.98
ACD/KOC (pH 5.5): 195.18
ACD/LogD (pH 7.4): 0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.77
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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