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ChemSpider 2D Image | 3-[2-(2-Bromobenzyl)-2H-tetrazol-5-yl]pyridine | C13H10BrN5

3-[2-(2-Bromobenzyl)-2H-tetrazol-5-yl]pyridine

  • Molecular FormulaC13H10BrN5
  • Average mass316.156 Da
  • Monoisotopic mass315.011963 Da
  • ChemSpider ID21664612

More details:






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

3-[2-(2-Brombenzyl)-2H-tetrazol-5-yl]pyridin [German] [ACD/IUPAC Name]
3-[2-(2-Bromobenzyl)-2H-tetrazol-5-yl]pyridine [ACD/IUPAC Name]
3-[2-(2-Bromobenzyl)-2H-tétrazol-5-yl]pyridine [French] [ACD/IUPAC Name]
Pyridine, 3-[2-[(2-bromophenyl)methyl]-2H-tetrazol-5-yl]- [ACD/Index Name]
2-[(2-bromophenyl)methyl]-5-(3-pyridyl)-1,2,3,4-tetraazole
3-[2-(2-Bromo-benzyl)-2H-tetrazol-5-yl]-pyridine

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

Density: 1.6±0.1 g/cm3
Boiling Point: 505.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.5±3.0 kJ/mol
Flash Point: 259.5±32.9 °C
Index of Refraction: 1.721
Molar Refractivity: 78.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 58.04
ACD/KOC (pH 5.5): 636.88
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 58.04
ACD/KOC (pH 7.4): 636.92
Polar Surface Area: 56 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 58.2±7.0 dyne/cm
Molar Volume: 198.6±7.0 cm3

Click to predict properties on the Chemicalize site






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