ChemSpider 2D Image | (7beta,20alpha)-1,18-Didehydro-7,20-dihydro-3,17-epoxy-7,20-cyclovobasan | C20H22N2O

(7β,20α)-1,18-Didehydro-7,20-dihydro-3,17-epoxy-7,20-cyclovobasan

  • Molecular FormulaC20H22N2O
  • Average mass306.401 Da
  • Monoisotopic mass306.173218 Da
  • ChemSpider ID129308837

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(7β,20α)-1,18-Didehydro-7,20-dihydro-3,17-epoxy-7,20-cyclovobasan [German] [ACD/IUPAC Name]
(7β,20α)-1,18-Didehydro-7,20-dihydro-3,17-epoxy-7,20-cyclovobasan [ACD/IUPAC Name]
(7β,20α)-1,18-Didéhydro-7,20-dihydro-3,17-époxy-7,20-cyclovobasan [French] [ACD/IUPAC Name]
7,20-Cyclovobasan, 1,18-didehydro-3,17-epoxy-7,20-dihydro-, (7β,20α)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 436.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.3±3.0 kJ/mol
Flash Point: 217.8±28.7 °C
Index of Refraction: 1.763
Molar Refractivity: 88.5±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.18
ACD/LogD (pH 5.5): -0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 2.40
ACD/KOC (pH 7.4): 25.61
Polar Surface Area: 25 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 55.6±7.0 dyne/cm
Molar Volume: 214.4±7.0 cm3

Click to predict properties on the Chemicalize site


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