ChemSpider 2D Image | 3,5,6-Triphenyl-1,2,4-triazine 2-oxide | C21H15N3O

3,5,6-Triphenyl-1,2,4-triazine 2-oxide

  • Molecular FormulaC21H15N3O
  • Average mass325.363 Da
  • Monoisotopic mass325.121521 Da
  • ChemSpider ID57469704

More details:

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

1,2,4-Triazine, 3,5,6-triphenyl-, 2-oxide [ACD/Index Name]
2-Oxyde de 3,5,6-triphényl-1,2,4-triazine [French] [ACD/IUPAC Name]
3,5,6-Triphenyl-1,2,4-triazin-2-oxid [German] [ACD/IUPAC Name]
3,5,6-Triphenyl-1,2,4-triazine 2-oxide [ACD/IUPAC Name]
2-Oxo-3,5,6-triphenyl-1,2λ5,4-triazine
745-45-9 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 538.3±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 78.5±3.0 kJ/mol
Flash Point: 279.4±30.9 °C
Index of Refraction: 1.651
Molar Refractivity: 100.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.05
ACD/LogD (pH 5.5): 3.70
ACD/BCF (pH 5.5): 379.59
ACD/KOC (pH 5.5): 2442.76
ACD/LogD (pH 7.4): 3.70
ACD/BCF (pH 7.4): 379.59
ACD/KOC (pH 7.4): 2442.76
Polar Surface Area: 51 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 49.1±7.0 dyne/cm
Molar Volume: 274.0±7.0 cm3

Click to predict properties on the Chemicalize site


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