ChemSpider 2D Image | (1-~2~H)-1H-Benzotriazole | C6H4DN3

(1-2H)-1H-Benzotriazole

  • Molecular FormulaC6H4DN3
  • Average mass120.130 Da
  • Monoisotopic mass120.054626 Da
  • ChemSpider ID95646123

  • Non-standard isotope - Non-standard isotope

More details:

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

(1-2H)-1H-Benzotriazol [German] [ACD/IUPAC Name]
(1-2H)-1H-Benzotriazole [ACD/IUPAC Name]
(1-2H)-1H-Benzotriazole [French] [ACD/IUPAC Name]
1H-1,2,3-Benzotriazole-1-d [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 359.2±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.5±3.0 kJ/mol
Flash Point: 185.7±12.2 °C
Index of Refraction: 1.715
Molar Refractivity: 34.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.34
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 8.77
ACD/KOC (pH 5.5): 164.56
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 7.95
ACD/KOC (pH 7.4): 149.33
Polar Surface Area: 42 Å2
Polarizability: 13.8±0.5 10-24cm3
Surface Tension: 74.0±3.0 dyne/cm
Molar Volume: 88.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement