ChemSpider 2D Image | Fragranol | C10H18O

Fragranol

  • Molecular FormulaC10H18O
  • Average mass154.249 Da
  • Monoisotopic mass154.135757 Da
  • ChemSpider ID28287139

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

2-[(1S,2S)-2-Isopropenyl-1-methylcyclobutyl]ethanol [German] [ACD/IUPAC Name]
2-[(1S,2S)-2-Isopropenyl-1-methylcyclobutyl]ethanol [ACD/IUPAC Name]
2-[(1S,2S)-2-Isopropényl-1-méthylcyclobutyl]éthanol [French] [ACD/IUPAC Name]
30346-21-5 [RN]
Cyclobutaneethanol, 1-methyl-2-(1-methylethenyl)-, (1S,2S)- [ACD/Index Name]
Fragranol
(±)-fragranol

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

Density: 0.9±0.1 g/cm3
Boiling Point: 209.9±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 51.9±6.0 kJ/mol
Flash Point: 78.5±15.0 °C
Index of Refraction: 1.468
Molar Refractivity: 47.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 2.63
ACD/BCF (pH 5.5): 58.22
ACD/KOC (pH 5.5): 638.37
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 58.22
ACD/KOC (pH 7.4): 638.37
Polar Surface Area: 20 Å2
Polarizability: 18.8±0.5 10-24cm3
Surface Tension: 29.9±3.0 dyne/cm
Molar Volume: 170.0±3.0 cm3

Click to predict properties on the Chemicalize site


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