ChemSpider 2D Image | 2-[(1R)-6-Isopropenyl-3-methyl-2-cyclohexen-1-yl]-5-(2-methyl-2-octanyl)-1,3-benzenediol | C25H38O2

2-[(1R)-6-Isopropenyl-3-methyl-2-cyclohexen-1-yl]-5-(2-methyl-2-octanyl)-1,3-benzenediol

  • Molecular FormulaC25H38O2
  • Average mass370.568 Da
  • Monoisotopic mass370.287170 Da
  • ChemSpider ID23954669

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

1,3-Benzenediol, 5-(1,1-dimethylheptyl)-2-[(1R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- [ACD/Index Name]
2-[(1R)-6-Isopropenyl-3-methyl-2-cyclohexen-1-yl]-5-(2-methyl-2-octanyl)-1,3-benzenediol [ACD/IUPAC Name]
2-[(1R)-6-Isopropényl-3-méthyl-2-cyclohexén-1-yl]-5-(2-méthyl-2-octanyl)-1,3-benzènediol [French] [ACD/IUPAC Name]
2-[(1R)-6-Isopropenyl-3-methyl-2-cyclohexen-1-yl]-5-(2-methyl-2-octanyl)-1,3-benzoldiol [German] [ACD/IUPAC Name]
5'-DMH-CBD (-)-
97452-63-6 [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: 502.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.0±3.0 kJ/mol
Flash Point: 213.4±24.7 °C
Index of Refraction: 1.529
Molar Refractivity: 115.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 8.79
ACD/LogD (pH 5.5): 8.27
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 750425.44
ACD/LogD (pH 7.4): 8.27
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 745390.06
Polar Surface Area: 40 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 37.7±3.0 dyne/cm
Molar Volume: 373.5±3.0 cm3

Click to predict properties on the Chemicalize site


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