ChemSpider 2D Image | 1H,1'H-5,5'-Bibenzotriazole | C12H8N6

1H,1'H-5,5'-Bibenzotriazole

  • Molecular FormulaC12H8N6
  • Average mass236.232 Da
  • Monoisotopic mass236.081039 Da
  • ChemSpider ID29368932

More details:

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

1H,1'H-5,5'-Bibenzotriazol [German] [ACD/IUPAC Name]
1H,1'H-5,5'-Bibenzotriazole [ACD/IUPAC Name]
1H,1'H-5,5'-Bibenzotriazole [French] [ACD/IUPAC Name]
5,5'-Bi-1H-1,2,3-benzotriazole [ACD/Index Name]
15805-13-7 [RN]
1H,1′H-5,5′-bibenzo[d][1,2,3]triazole
3H,3'H-5,5'-Bibenzo[d][1,2,3]triazole
5-(1H-1,2,3-benzotriazol-5-yl)-1H-1,2,3-benzotriazole

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

Density: 1.5±0.1 g/cm3
Boiling Point: 715.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.6±3.0 kJ/mol
Flash Point: 352.6±18.9 °C
Index of Refraction: 1.844
Molar Refractivity: 67.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.10
ACD/LogD (pH 5.5): 2.34
ACD/BCF (pH 5.5): 35.08
ACD/KOC (pH 5.5): 443.51
ACD/LogD (pH 7.4): 2.17
ACD/BCF (pH 7.4): 24.11
ACD/KOC (pH 7.4): 304.75
Polar Surface Area: 83 Å2
Polarizability: 26.9±0.5 10-24cm3
Surface Tension: 101.6±3.0 dyne/cm
Molar Volume: 152.5±3.0 cm3

Click to predict properties on the Chemicalize site


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