ChemSpider 2D Image | Bicyclo[2.2.2]oct-2-ene | C8H12

Bicyclo[2.2.2]oct-2-ene

  • Molecular FormulaC8H12
  • Average mass108.181 Da
  • Monoisotopic mass108.093903 Da
  • ChemSpider ID29367599

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1s,4s)-Bicyclo[2.2.2]oct-2-en [German] [ACD/IUPAC Name]
(1s,4s)-Bicyclo[2.2.2]oct-2-ene [ACD/IUPAC Name]
(1s,4s)-Bicyclo[2.2.2]oct-2-ène [French] [ACD/IUPAC Name]
Bicyclo[2.2.2]oct-2-ene [ACD/Index Name] [ACD/IUPAC Name]
2,2,2-Bicyclo-2-octene
931-64-6 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 138.3±7.0 °C at 760 mmHg
Vapour Pressure: 8.4±0.1 mmHg at 25°C
Enthalpy of Vaporization: 36.0±0.8 kJ/mol
Flash Point: 18.5±10.3 °C
Index of Refraction: 1.506
Molar Refractivity: 34.5±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.31
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 75.63
ACD/KOC (pH 5.5): 769.82
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 75.63
ACD/KOC (pH 7.4): 769.82
Polar Surface Area: 0 Å2
Polarizability: 13.7±0.5 10-24cm3
Surface Tension: 33.9±3.0 dyne/cm
Molar Volume: 116.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement