ChemSpider 2D Image | 4-{[5-(3-Pyridinyl)-2H-tetrazol-2-yl]methyl}benzonitrile | C14H10N6

4-{[5-(3-Pyridinyl)-2H-tetrazol-2-yl]methyl}benzonitrile

  • Molecular FormulaC14H10N6
  • Average mass262.269 Da
  • Monoisotopic mass262.096680 Da
  • ChemSpider ID24739896

More details:

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

4-{[5-(3-Pyridinyl)-2H-tetrazol-2-yl]methyl}benzonitril [German] [ACD/IUPAC Name]
4-{[5-(3-Pyridinyl)-2H-tetrazol-2-yl]methyl}benzonitrile [ACD/IUPAC Name]
4-{[5-(3-Pyridinyl)-2H-tétrazol-2-yl]méthyl}benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4-[[5-(3-pyridinyl)-2H-tetrazol-2-yl]methyl]- [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: 535.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 277.6±32.9 °C
Index of Refraction: 1.707
Molar Refractivity: 77.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 6.64
ACD/KOC (pH 5.5): 134.92
ACD/LogD (pH 7.4): 1.38
ACD/BCF (pH 7.4): 6.64
ACD/KOC (pH 7.4): 134.93
Polar Surface Area: 80 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 58.8±7.0 dyne/cm
Molar Volume: 198.9±7.0 cm3

Click to predict properties on the Chemicalize site


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