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

2,5-Dibromo-4-hydroxybenzonitrile

  • Molecular FormulaC7H3Br2NO
  • Average mass276.913 Da
  • Monoisotopic mass274.858124 Da
  • ChemSpider ID38238407

More details:

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

2,5-Dibrom-4-hydroxybenzonitril [German] [ACD/IUPAC Name]
2,5-Dibromo-4-hydroxybenzonitrile [ACD/IUPAC Name]
2,5-Dibromo-4-hydroxybenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2,5-dibromo-4-hydroxy- [ACD/Index Name]
1824055-68-6 [RN]
MFCD28053778

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

    Density: 2.2±0.1 g/cm3
    Boiling Point: 329.1±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 59.4±3.0 kJ/mol
    Flash Point: 152.8±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: 3.28
    ACD/LogD (pH 5.5): 2.88
    ACD/BCF (pH 5.5): 73.46
    ACD/KOC (pH 5.5): 588.58
    ACD/LogD (pH 7.4): 1.24
    ACD/BCF (pH 7.4): 1.70
    ACD/KOC (pH 7.4): 13.59
    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

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