ChemSpider 2D Image | 3-Chloro-4,5-diphenyl-4H-1,2,4-triazole | C14H10ClN3

3-Chloro-4,5-diphenyl-4H-1,2,4-triazole

  • Molecular FormulaC14H10ClN3
  • Average mass255.702 Da
  • Monoisotopic mass255.056320 Da
  • ChemSpider ID22370513

More details:

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

3-Chlor-4,5-diphenyl-4H-1,2,4-triazol [German] [ACD/IUPAC Name]
3-Chloro-4,5-diphenyl-4H-1,2,4-triazole [ACD/IUPAC Name]
3-Chloro-4,5-diphényl-4H-1,2,4-triazole [French] [ACD/IUPAC Name]
4H-1,2,4-Triazole, 3-chloro-4,5-diphenyl- [ACD/Index Name]
57022-97-6 [RN]
MFCD09995933 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 446.8±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 224.0±24.0 °C
Index of Refraction: 1.655
Molar Refractivity: 74.1±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.03
ACD/LogD (pH 5.5): 3.93
ACD/BCF (pH 5.5): 570.64
ACD/KOC (pH 5.5): 3270.44
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 570.64
ACD/KOC (pH 7.4): 3270.44
Polar Surface Area: 31 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 48.5±7.0 dyne/cm
Molar Volume: 202.0±7.0 cm3

Click to predict properties on the Chemicalize site


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