ChemSpider 2D Image | 5-(2-Bromo-5-methoxyphenyl)-2-methyl-2H-tetrazole | C9H9BrN4O

5-(2-Bromo-5-methoxyphenyl)-2-methyl-2H-tetrazole

  • Molecular FormulaC9H9BrN4O
  • Average mass269.098 Da
  • Monoisotopic mass267.995972 Da
  • ChemSpider ID30492684

More details:

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

2H-Tetrazole, 5-(2-bromo-5-methoxyphenyl)-2-methyl- [ACD/Index Name]
5-(2-Brom-5-methoxyphenyl)-2-methyl-2H-tetrazol [German] [ACD/IUPAC Name]
5-(2-Bromo-5-methoxyphenyl)-2-methyl-2H-tetrazole [ACD/IUPAC Name]
5-(2-Bromo-5-méthoxyphényl)-2-méthyl-2H-tétrazole [French] [ACD/IUPAC Name]
1436158-80-3 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4521429/

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

Density: 1.7±0.1 g/cm3
Boiling Point: 415.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.8±3.0 kJ/mol
Flash Point: 204.9±31.5 °C
Index of Refraction: 1.668
Molar Refractivity: 60.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.18
ACD/LogD (pH 5.5): 2.17
ACD/BCF (pH 5.5): 26.24
ACD/KOC (pH 5.5): 360.79
ACD/LogD (pH 7.4): 2.17
ACD/BCF (pH 7.4): 26.24
ACD/KOC (pH 7.4): 360.80
Polar Surface Area: 53 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 50.3±7.0 dyne/cm
Molar Volume: 162.7±7.0 cm3

Click to predict properties on the Chemicalize site


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