ChemSpider 2D Image | (1R,5R)-5-Isopropenyl-2-methylenecyclohexyl acetate | C12H18O2

(1R,5R)-5-Isopropenyl-2-methylenecyclohexyl acetate

  • Molecular FormulaC12H18O2
  • Average mass194.270 Da
  • Monoisotopic mass194.130676 Da
  • ChemSpider ID34992330

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,5R)-5-Isopropenyl-2-methylencyclohexyl-acetat [German] [ACD/IUPAC Name]
(1R,5R)-5-Isopropenyl-2-methylenecyclohexyl acetate [ACD/IUPAC Name]
Acétate de (1R,5R)-5-isopropényl-2-méthylènecyclohexyle [French] [ACD/IUPAC Name]
Cyclohexanol, 2-methylene-5-(1-methylethenyl)-, acetate, (1R,5R)- [ACD/Index Name]
L6YTJ AU1 BOV1 DY1&U1 &&(1R,5R)- Form [WLN]

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

UNII-MEP6WAS0OH [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 243.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.1±3.0 kJ/mol
Flash Point: 92.7±14.9 °C
Index of Refraction: 1.468
Molar Refractivity: 56.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 3.38
ACD/BCF (pH 5.5): 217.78
ACD/KOC (pH 5.5): 1641.18
ACD/LogD (pH 7.4): 3.38
ACD/BCF (pH 7.4): 217.78
ACD/KOC (pH 7.4): 1641.18
Polar Surface Area: 26 Å2
Polarizability: 22.4±0.5 10-24cm3
Surface Tension: 29.6±5.0 dyne/cm
Molar Volume: 203.0±5.0 cm3

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