ChemSpider 2D Image | 5-Bromo-1-(4-methoxybenzyl)-1H-tetrazole | C9H9BrN4O

5-Bromo-1-(4-methoxybenzyl)-1H-tetrazole

  • Molecular FormulaC9H9BrN4O
  • Average mass269.098 Da
  • Monoisotopic mass267.995972 Da
  • ChemSpider ID13480272

More details:

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

1H-Tetrazole, 5-bromo-1-[(4-methoxyphenyl)methyl]- [ACD/Index Name]
5-Brom-1-(4-methoxybenzyl)-1H-tetrazol [German] [ACD/IUPAC Name]
5-Bromo-1-(4-methoxybenzyl)-1H-tetrazole [ACD/IUPAC Name]
5-Bromo-1-(4-méthoxybenzyl)-1H-tétrazole [French] [ACD/IUPAC Name]
188890-67-7 [RN]
5-Bromo-1-[(4-methoxyphenyl)methyl]-1H-tetrazole
MFCD16338691

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

Density: 1.6±0.1 g/cm3
Boiling Point: 416.5±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.0±3.0 kJ/mol
Flash Point: 205.7±29.3 °C
Index of Refraction: 1.666
Molar Refractivity: 60.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 19.25
ACD/KOC (pH 5.5): 289.04
ACD/LogD (pH 7.4): 1.99
ACD/BCF (pH 7.4): 19.25
ACD/KOC (pH 7.4): 289.04
Polar Surface Area: 53 Å2
Polarizability: 24.1±0.5 10-24cm3
Surface Tension: 52.7±7.0 dyne/cm
Molar Volume: 163.6±7.0 cm3

Click to predict properties on the Chemicalize site


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