ChemSpider 2D Image | 4-[5-(4-Bromophenyl)-2H-tetrazol-2-yl]butanenitrile | C11H10BrN5

4-[5-(4-Bromophenyl)-2H-tetrazol-2-yl]butanenitrile

  • Molecular FormulaC11H10BrN5
  • Average mass292.135 Da
  • Monoisotopic mass291.011963 Da
  • ChemSpider ID26164926

More details:

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

2H-Tetrazole-2-butanenitrile, 5-(4-bromophenyl)- [ACD/Index Name]
4-[5-(4-Bromophenyl)-2H-tetrazol-2-yl]butanenitrile [ACD/IUPAC Name]
4-[5-(4-Bromophényl)-2H-tétrazol-2-yl]butanenitrile [French] [ACD/IUPAC Name]
4-[5-(4-Bromphenyl)-2H-tetrazol-2-yl]butannitril [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 481.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.6±3.0 kJ/mol
Flash Point: 244.8±31.5 °C
Index of Refraction: 1.681
Molar Refractivity: 70.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.20
ACD/LogD (pH 5.5): 2.05
ACD/BCF (pH 5.5): 21.35
ACD/KOC (pH 5.5): 311.33
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 21.35
ACD/KOC (pH 7.4): 311.33
Polar Surface Area: 67 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 56.9±7.0 dyne/cm
Molar Volume: 187.0±7.0 cm3

Click to predict properties on the Chemicalize site


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