ChemSpider 2D Image | 1-Bromobicyclo[2.2.2]octane | C8H13Br

1-Bromobicyclo[2.2.2]octane

  • Molecular FormulaC8H13Br
  • Average mass189.093 Da
  • Monoisotopic mass188.020050 Da
  • ChemSpider ID96451108

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-Brombicyclo[2.2.2]octan [German] [ACD/IUPAC Name]
1-Bromobicyclo[2.2.2]octane [ACD/IUPAC Name]
1-Bromobicyclo[2.2.2]octane [French] [ACD/IUPAC Name]
Bicyclo[2.2.2]octane, 1-bromo- [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: 198.2±9.0 °C at 760 mmHg
Vapour Pressure: 0.5±0.4 mmHg at 25°C
Enthalpy of Vaporization: 41.7±3.0 kJ/mol
Flash Point: 74.8±8.4 °C
Index of Refraction: 1.559
Molar Refractivity: 42.6±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.61
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 159.09
ACD/KOC (pH 5.5): 1310.81
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 159.09
ACD/KOC (pH 7.4): 1310.81
Polar Surface Area: 0 Å2
Polarizability: 16.9±0.5 10-24cm3
Surface Tension: 43.1±3.0 dyne/cm
Molar Volume: 132.1±3.0 cm3

Click to predict properties on the Chemicalize site


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