ChemSpider 2D Image | 3,6-Bis(octyloxy)tricyclo[6.2.1.0~2,7~]undeca-2,4,6,9-tetraene | C27H42O2

3,6-Bis(octyloxy)tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraene

  • Molecular FormulaC27H42O2
  • Average mass398.621 Da
  • Monoisotopic mass398.318481 Da
  • ChemSpider ID28592679

More details:

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

1,4-Methanonaphthalene, 1,4-dihydro-5,8-bis(octyloxy)- [ACD/Index Name]
3,6-Bis(octyloxy)tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraen [German] [ACD/IUPAC Name]
3,6-Bis(octyloxy)tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraene [ACD/IUPAC Name]
3,6-Bis(octyloxy)tricyclo[6.2.1.02,7]undéca-2,4,6,9-tétraène [French] [ACD/IUPAC Name]
5,8-Bis(octyloxy)-1,4-dihydro-1,4-methanonaphthalene
920287-07-6 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 486.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.4±3.0 kJ/mol
Flash Point: 150.1±28.3 °C
Index of Refraction: 1.518
Molar Refractivity: 123.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 10.70
ACD/LogD (pH 5.5): 9.76
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 4824800.00
ACD/LogD (pH 7.4): 9.76
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 4824800.00
Polar Surface Area: 18 Å2
Polarizability: 49.0±0.5 10-24cm3
Surface Tension: 36.9±3.0 dyne/cm
Molar Volume: 407.4±3.0 cm3

Click to predict properties on the Chemicalize site


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