ChemSpider 2D Image | 2-(5-Phenyl-2H-tetrazol-2-yl)nicotinonitrile | C13H8N6

2-(5-Phenyl-2H-tetrazol-2-yl)nicotinonitrile

  • Molecular FormulaC13H8N6
  • Average mass248.243 Da
  • Monoisotopic mass248.081039 Da
  • ChemSpider ID24308244

More details:

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

2-(5-Phenyl-2H-tetrazol-2-yl)nicotinonitril [German] [ACD/IUPAC Name]
2-(5-Phenyl-2H-tetrazol-2-yl)nicotinonitrile [ACD/IUPAC Name]
2-(5-Phényl-2H-tétrazol-2-yl)nicotinonitrile [French] [ACD/IUPAC Name]
3-Pyridinecarbonitrile, 2-(5-phenyl-2H-tetrazol-2-yl)- [ACD/Index Name]
2-(5-phenyl-2H-1,2,3,4-tetrazol-2-yl)pyridine-3-carbonitrile

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

Density: 1.4±0.1 g/cm3
Boiling Point: 509.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.0±3.0 kJ/mol
Flash Point: 261.9±32.9 °C
Index of Refraction: 1.729
Molar Refractivity: 72.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.88
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 6.51
ACD/KOC (pH 5.5): 133.04
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 6.51
ACD/KOC (pH 7.4): 133.04
Polar Surface Area: 80 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 61.6±7.0 dyne/cm
Molar Volume: 182.8±7.0 cm3

Click to predict properties on the Chemicalize site


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