ChemSpider 2D Image | 17-Allyl-3-methoxy-7,8-didehydro-4,5-epoxymorphinan-6-ol | C20H23NO3

17-Allyl-3-methoxy-7,8-didehydro-4,5-epoxymorphinan-6-ol

  • Molecular FormulaC20H23NO3
  • Average mass325.401 Da
  • Monoisotopic mass325.167786 Da
  • ChemSpider ID58820361

  • defined stereocentres - 3 of 5 defined stereocentres

More details:

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

17-Allyl-3-methoxy-7,8-didehydro-4,5-epoxymorphinan-6-ol [German] [ACD/IUPAC Name]
17-Allyl-3-methoxy-7,8-didehydro-4,5-epoxymorphinan-6-ol [ACD/IUPAC Name]
17-Allyl-3-méthoxy-7,8-didéhydro-4,5-époxymorphinane-6-ol [French] [ACD/IUPAC Name]
Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-(2-propen-1-yl)- [ACD/Index Name]
(5α,6α)-17-allyl-7,8-didehydro-4,5-epoxy-3-methoxymorphinan-6-ol
56195-50-7 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 481.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 245.3±28.7 °C
Index of Refraction: 1.655
Molar Refractivity: 91.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.75
ACD/LogD (pH 5.5): -0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.22
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 4.99
ACD/KOC (pH 7.4): 88.65
Polar Surface Area: 42 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 57.8±5.0 dyne/cm
Molar Volume: 250.3±5.0 cm3

Click to predict properties on the Chemicalize site


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