ChemSpider 2D Image | (1S,4Z,8E,10R)-4,8,11,11-Tetramethylbicyclo[8.1.0]undeca-4,8-dien-3-one | C15H22O

(1S,4Z,8E,10R)-4,8,11,11-Tetramethylbicyclo[8.1.0]undeca-4,8-dien-3-one

  • Molecular FormulaC15H22O
  • Average mass218.335 Da
  • Monoisotopic mass218.167068 Da
  • ChemSpider ID35516994

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,4Z,8E,10R)-4,8,11,11-Tetramethylbicyclo[8.1.0]undeca-4,8-dien-3-on [German] [ACD/IUPAC Name]
(1S,4Z,8E,10R)-4,8,11,11-Tetramethylbicyclo[8.1.0]undeca-4,8-dien-3-one [ACD/IUPAC Name]
(1S,4Z,8E,10R)-4,8,11,11-Tétraméthylbicyclo[8.1.0]undéca-4,8-dién-3-one [French] [ACD/IUPAC Name]
Bicyclo[8.1.0]undeca-4,8-dien-3-one, 4,8,11,11-tetramethyl-, (1S,4Z,8E,10R)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 315.5±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.7±3.0 kJ/mol
Flash Point: 140.9±15.9 °C
Index of Refraction: 1.484
Molar Refractivity: 66.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.39
ACD/LogD (pH 5.5): 4.62
ACD/BCF (pH 5.5): 1921.82
ACD/KOC (pH 5.5): 7799.72
ACD/LogD (pH 7.4): 4.62
ACD/BCF (pH 7.4): 1921.82
ACD/KOC (pH 7.4): 7799.72
Polar Surface Area: 17 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 27.9±3.0 dyne/cm
Molar Volume: 233.6±3.0 cm3

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