ChemSpider 2D Image | 4-Hydroxy(~2~H_4_)benzonitrile | C7HD4NO

4-Hydroxy(2H4)benzonitrile

  • Molecular FormulaC7HD4NO
  • Average mass123.145 Da
  • Monoisotopic mass123.062218 Da
  • ChemSpider ID24533077

  • Non-standard isotope - Non-standard isotope

More details:

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

4-Hydroxy(2H4)benzonitril [German] [ACD/IUPAC Name]
4-Hydroxy(2H4)benzonitrile [ACD/IUPAC Name]
4-Hydroxy(2H4)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile-2,3,5,6-d4, 4-hydroxy- [ACD/Index Name]
1025089-21-7 [RN]
4-cyanophenol 2,3,5,6-d4
4-Cyanophenol-2,3,5,6-d4
MFCD08704964

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 281.2±23.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.1±3.0 kJ/mol
    Flash Point: 123.9±22.6 °C
    Index of Refraction: 1.591
    Molar Refractivity: 32.8±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.60
    ACD/LogD (pH 5.5): 1.69
    ACD/BCF (pH 5.5): 11.24
    ACD/KOC (pH 5.5): 196.42
    ACD/LogD (pH 7.4): 1.54
    ACD/BCF (pH 7.4): 8.02
    ACD/KOC (pH 7.4): 140.04
    Polar Surface Area: 44 Å2
    Polarizability: 13.0±0.5 10-24cm3
    Surface Tension: 57.9±5.0 dyne/cm
    Molar Volume: 97.3±5.0 cm3

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