ChemSpider 2D Image | 4-Hydroxy(3,5-~13~C_2_,2,6-~2~H_2_)benzonitrile | C513C2H3D2NO

4-Hydroxy(3,5-13C2,2,6-2H2)benzonitrile

  • Molecular FormulaC513C2H3D2NO
  • Average mass123.118 Da
  • Monoisotopic mass123.056374 Da
  • ChemSpider ID74793201

  • Non-standard isotope - Non-standard isotope

More details:

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

4-Hydroxy(3,5-13C2,2,6-2H2)benzonitril [German] [ACD/IUPAC Name]
4-Hydroxy(3,5-13C2,2,6-2H2)benzonitrile [ACD/IUPAC Name]
4-Hydroxy(3,5-13C2,2,6-2H2)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile-3,5-13C2-2,6-d2, 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.591
Molar Refractivity: 32.8±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 13.0±0.5 10-24cm3
Surface Tension: 57.9±5.0 dyne/cm
Molar Volume: 97.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement