ChemSpider 2D Image | (1R,3R)-3-[(1R,2S,4R,6S)-5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl]cyclohexanol | C16H28O

(1R,3R)-3-[(1R,2S,4R,6S)-5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl]cyclohexanol

  • Molecular FormulaC16H28O
  • Average mass236.393 Da
  • Monoisotopic mass236.214020 Da
  • ChemSpider ID62532344

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(1R,3R)-3-[(1R,2S,4R,6S)-5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl]cyclohexanol [German] [ACD/IUPAC Name]
(1R,3R)-3-[(1R,2S,4R,6S)-5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl]cyclohexanol [ACD/IUPAC Name]
(1R,3R)-3-[(1R,2S,4R,6S)-5,5,6-Triméthylbicyclo[2.2.1]hept-2-yl]cyclohexanol [French] [ACD/IUPAC Name]
Cyclohexanol, 3-[(1R,2S,4R,6S)-5,5,6-trimethylbicyclo[2.2.1]hept-2-yl]-, (1R,3R)- [ACD/Index 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: 324.5±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 65.7±6.0 kJ/mol
Flash Point: 136.5±11.5 °C
Index of Refraction: 1.507
Molar Refractivity: 71.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 5.27
ACD/LogD (pH 5.5): 4.40
ACD/BCF (pH 5.5): 1290.82
ACD/KOC (pH 5.5): 5866.19
ACD/LogD (pH 7.4): 4.40
ACD/BCF (pH 7.4): 1290.82
ACD/KOC (pH 7.4): 5866.19
Polar Surface Area: 20 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 34.8±3.0 dyne/cm
Molar Volume: 240.7±3.0 cm3

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