ChemSpider 2D Image | (5beta)-14-Hydroxy-3,4-dimethoxy-5,17-dimethylmorphinan-6-one | C20H27NO4

(5β)-14-Hydroxy-3,4-dimethoxy-5,17-dimethylmorphinan-6-one

  • Molecular FormulaC20H27NO4
  • Average mass345.433 Da
  • Monoisotopic mass345.194000 Da
  • ChemSpider ID30653810

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(5β)-14-Hydroxy-3,4-dimethoxy-5,17-dimethylmorphinan-6-on [German] [ACD/IUPAC Name]
(5β)-14-Hydroxy-3,4-dimethoxy-5,17-dimethylmorphinan-6-one [ACD/IUPAC Name]
(5β)-14-Hydroxy-3,4-diméthoxy-5,17-diméthylmorphinane-6-one [French] [ACD/IUPAC Name]
Morphinan-6-one, 14-hydroxy-3,4-dimethoxy-5,17-dimethyl-, (5β)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 509.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.1±3.0 kJ/mol
Flash Point: 261.6±30.1 °C
Index of Refraction: 1.598
Molar Refractivity: 94.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.30
ACD/LogD (pH 5.5): -0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.87
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 5.60
ACD/KOC (pH 7.4): 87.95
Polar Surface Area: 59 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 53.6±5.0 dyne/cm
Molar Volume: 276.6±5.0 cm3

Click to predict properties on the Chemicalize site


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