ChemSpider 2D Image | 3-Methyl-2-{3-methyl-5-[4-(2-methyl-2H-tetrazol-5-yl)phenyl]-1H-1,2,4-triazol-1-yl}pyridine | C17H16N8

3-Methyl-2-{3-methyl-5-[4-(2-methyl-2H-tetrazol-5-yl)phenyl]-1H-1,2,4-triazol-1-yl}pyridine

  • Molecular FormulaC17H16N8
  • Average mass332.362 Da
  • Monoisotopic mass332.149780 Da
  • ChemSpider ID29612816

More details:

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

3-Methyl-2-{3-methyl-5-[4-(2-methyl-2H-tetrazol-5-yl)phenyl]-1H-1,2,4-triazol-1-yl}pyridin [German] [ACD/IUPAC Name]
3-Methyl-2-{3-methyl-5-[4-(2-methyl-2H-tetrazol-5-yl)phenyl]-1H-1,2,4-triazol-1-yl}pyridine [ACD/IUPAC Name]
3-Méthyl-2-{3-méthyl-5-[4-(2-méthyl-2H-tétrazol-5-yl)phényl]-1H-1,2,4-triazol-1-yl}pyridine [French] [ACD/IUPAC Name]
Pyridine, 3-methyl-2-[3-methyl-5-[4-(2-methyl-2H-tetrazol-5-yl)phenyl]-1H-1,2,4-triazol-1-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 608.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.4±3.0 kJ/mol
Flash Point: 321.8±34.3 °C
Index of Refraction: 1.738
Molar Refractivity: 96.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.60
ACD/LogD (pH 5.5): 2.31
ACD/BCF (pH 5.5): 33.78
ACD/KOC (pH 5.5): 432.34
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 33.78
ACD/KOC (pH 7.4): 432.37
Polar Surface Area: 87 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 56.3±7.0 dyne/cm
Molar Volume: 239.4±7.0 cm3

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