ChemSpider 2D Image | Bicyclo[2.2.2]octa-2,5,7-trien | C8H8

Bicyclo[2.2.2]octa-2,5,7-trien

  • Molecular FormulaC8H8
  • Average mass104.149 Da
  • Monoisotopic mass104.062599 Da
  • ChemSpider ID74037986

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Bicyclo[2.2.2]octa-2,5,7-trien [ACD/IUPAC Name]
Bicyclo[2.2.2]octa-2,5,7-trien [German] [ACD/IUPAC Name]
Bicyclo[2.2.2]octa-2,5,7-triene [ACD/Index Name] [ACD/IUPAC Name]
Bicyclo[2.2.2]octa-2,5,7-triène [ACD/IUPAC Name]
Bicyclo[2.2.2]octa-2,5,7-triène [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 153.7±35.0 °C at 760 mmHg
Vapour Pressure: 4.2±0.1 mmHg at 25°C
Enthalpy of Vaporization: 37.4±0.8 kJ/mol
Flash Point: 22.3±20.8 °C
Index of Refraction: 1.570
Molar Refractivity: 33.8±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.02
ACD/LogD (pH 5.5): 2.07
ACD/BCF (pH 5.5): 22.17
ACD/KOC (pH 5.5): 319.82
ACD/LogD (pH 7.4): 2.07
ACD/BCF (pH 7.4): 22.17
ACD/KOC (pH 7.4): 319.82
Polar Surface Area: 0 Å2
Polarizability: 13.4±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 102.8±3.0 cm3

Click to predict properties on the Chemicalize site


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