ChemSpider 2D Image | (1R,4S,5R)-5-Isopropenyl-6-methylene-2-cyclohexene-1,4-diol | C10H14O2

(1R,4S,5R)-5-Isopropenyl-6-methylene-2-cyclohexene-1,4-diol

  • Molecular FormulaC10H14O2
  • Average mass166.217 Da
  • Monoisotopic mass166.099380 Da
  • ChemSpider ID61455474

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1R,4S,5R)-5-Isopropenyl-6-methylen-2-cyclohexen-1,4-diol [German] [ACD/IUPAC Name]
(1R,4S,5R)-5-Isopropenyl-6-methylene-2-cyclohexene-1,4-diol [ACD/IUPAC Name]
(1R,4S,5R)-5-Isopropényl-6-méthylène-2-cyclohexène-1,4-diol [French] [ACD/IUPAC Name]
2-Cyclohexene-1,4-diol, 5-methylene-6-(1-methylethenyl)-, (1S,4R,6R)- [ACD/Index Name]
32151-10-3 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 280.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 60.2±6.0 kJ/mol
Flash Point: 131.6±21.9 °C
Index of Refraction: 1.532
Molar Refractivity: 48.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.05
ACD/LogD (pH 5.5): 1.03
ACD/BCF (pH 5.5): 3.57
ACD/KOC (pH 5.5): 86.59
ACD/LogD (pH 7.4): 1.03
ACD/BCF (pH 7.4): 3.57
ACD/KOC (pH 7.4): 86.59
Polar Surface Area: 40 Å2
Polarizability: 19.1±0.5 10-24cm3
Surface Tension: 38.2±5.0 dyne/cm
Molar Volume: 155.8±5.0 cm3

Click to predict properties on the Chemicalize site


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