ChemSpider 2D Image | 2-[(1R,2R)-2-{(1R)-1-Hydroxy-1-[(1S)-4-methyl-3-cyclohexen-1-yl]ethyl}cyclopropyl]-2-propanol | C15H26O2

2-[(1R,2R)-2-{(1R)-1-Hydroxy-1-[(1S)-4-methyl-3-cyclohexen-1-yl]ethyl}cyclopropyl]-2-propanol

  • Molecular FormulaC15H26O2
  • Average mass238.366 Da
  • Monoisotopic mass238.193283 Da
  • ChemSpider ID78439482

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1,2-Cyclopropanedimethanol, α1,α1,α2-trimethyl-α2-[(1S)-4-methyl-3-cyclohexen-1-yl]-, (α2R,1R,2R)- [ACD/Index Name]
2-[(1R,2R)-2-{(1R)-1-Hydroxy-1-[(1S)-4-methyl-3-cyclohexen-1-yl]ethyl}cyclopropyl]-2-propanol [German] [ACD/IUPAC Name]
2-[(1R,2R)-2-{(1R)-1-Hydroxy-1-[(1S)-4-methyl-3-cyclohexen-1-yl]ethyl}cyclopropyl]-2-propanol [ACD/IUPAC Name]
2-[(1R,2R)-2-{(1R)-1-Hydroxy-1-[(1S)-4-méthyl-3-cyclohexén-1-yl]éthyl}cyclopropyl]-2-propanol [French] [ACD/IUPAC Name]
Phellilane L

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

Density: 1.1±0.1 g/cm3
Boiling Point: 339.9±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 67.6±6.0 kJ/mol
Flash Point: 151.9±15.0 °C
Index of Refraction: 1.539
Molar Refractivity: 69.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.51
ACD/LogD (pH 5.5): 2.93
ACD/BCF (pH 5.5): 98.60
ACD/KOC (pH 5.5): 930.76
ACD/LogD (pH 7.4): 2.93
ACD/BCF (pH 7.4): 98.60
ACD/KOC (pH 7.4): 930.76
Polar Surface Area: 40 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 221.5±3.0 cm3

Click to predict properties on the Chemicalize site


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