ChemSpider 2D Image | (4beta,5beta,6beta,7beta)-9-Hydroxyaristola-1,9-dien-8-one | C15H20O2

(4β,5β,6β,7β)-9-Hydroxyaristola-1,9-dien-8-one

  • Molecular FormulaC15H20O2
  • Average mass232.318 Da
  • Monoisotopic mass232.146332 Da
  • ChemSpider ID78442133

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(4β,5β,6β,7β)-9-Hydroxyaristola-1,9-dien-8-on [German] [ACD/IUPAC Name]
(4β,5β,6β,7β)-9-Hydroxyaristola-1,9-dien-8-one [ACD/IUPAC Name]
(4β,5β,6β,7β)-9-Hydroxyaristola-1,9-dién-8-one [French] [ACD/IUPAC Name]
2H-Cyclopropa[a]naphthalen-2-one, 1,1a,6,7,7a,7b-hexahydro-3-hydroxy-1,1,7,7a-tetramethyl-, (1aS,7S,7aS,7bR)- [ACD/Index Name]
(+)-1,2-didehydro-9-hydroxy-aristlone

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

Density: 1.1±0.1 g/cm3
Boiling Point: 374.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 71.9±6.0 kJ/mol
Flash Point: 159.8±15.8 °C
Index of Refraction: 1.566
Molar Refractivity: 66.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 233.72
ACD/KOC (pH 5.5): 1726.19
ACD/LogD (pH 7.4): 3.41
ACD/BCF (pH 7.4): 229.94
ACD/KOC (pH 7.4): 1698.30
Polar Surface Area: 37 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 42.4±5.0 dyne/cm
Molar Volume: 203.2±5.0 cm3

Click to predict properties on the Chemicalize site


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