ChemSpider 2D Image | 4,4'-Dihexyl-1,1'-bi(bicyclo[2.2.2]octane) | C28H50

4,4'-Dihexyl-1,1'-bi(bicyclo[2.2.2]octane)

  • Molecular FormulaC28H50
  • Average mass386.697 Da
  • Monoisotopic mass386.391266 Da
  • ChemSpider ID57500289

More details:






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

1,1'-Bibicyclo[2.2.2]octane, 4,4'-dihexyl- [ACD/Index Name]
4,4'-Dihexyl-1,1'-bi(bicyclo[2.2.2]octan) [German] [ACD/IUPAC Name]
4,4'-Dihexyl-1,1'-bi(bicyclo[2.2.2]octane) [ACD/IUPAC Name]
4,4'-Dihexyl-1,1'-bi(bicyclo[2.2.2]octane) [French] [ACD/IUPAC Name]
1-HEXYL-4-{4-HEXYLBICYCLO[2.2.2]OCTAN-1-YL}BICYCLO[2.2.2]OCTANE
80060-70-4 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 454.4±12.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 68.7±0.8 kJ/mol
Flash Point: 218.0±13.1 °C
Index of Refraction: 1.519
Molar Refractivity: 123.3±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 13.02
ACD/LogD (pH 5.5): 11.61
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.61
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 48.9±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 405.8±3.0 cm3

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