ChemSpider 2D Image | [4-Hydroxy(~2~H_4_)phenyl]acetonitrile | C8H3D4NO

[4-Hydroxy(2H4)phenyl]acetonitrile

  • Molecular FormulaC8H3D4NO
  • Average mass137.172 Da
  • Monoisotopic mass137.077866 Da
  • ChemSpider ID114810331

  • Non-standard isotope - Non-standard isotope

More details:

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

[4-Hydroxy(2H4)phenyl]acetonitril [German] [ACD/IUPAC Name]
[4-Hydroxy(2H4)phenyl]acetonitrile [ACD/IUPAC Name]
[4-Hydroxy(2H4)phényl]acétonitrile [French] [ACD/IUPAC Name]
Benzene-2,3,5,6-d4-acetonitrile, 4-hydroxy- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 330.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.5±3.0 kJ/mol
Flash Point: 137.2±20.9 °C
Index of Refraction: 1.573
Molar Refractivity: 37.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.71
ACD/LogD (pH 5.5): 1.42
ACD/BCF (pH 5.5): 7.06
ACD/KOC (pH 5.5): 140.96
ACD/LogD (pH 7.4): 1.42
ACD/BCF (pH 7.4): 7.02
ACD/KOC (pH 7.4): 140.15
Polar Surface Area: 44 Å2
Polarizability: 14.9±0.5 10-24cm3
Surface Tension: 52.6±3.0 dyne/cm
Molar Volume: 114.1±3.0 cm3

Click to predict properties on the Chemicalize site


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