ChemSpider 2D Image | (5alpha,6alpha)-6-Hydroxy-17-methyl(1-~3~H)-7,8-didehydro-4,5-epoxymorphinan-3-yl acetate | C19H20TNO4

(5α,6α)-6-Hydroxy-17-methyl(1-3H)-7,8-didehydro-4,5-epoxymorphinan-3-yl acetate

  • Molecular FormulaC19H20TNO4
  • Average mass329.382 Da
  • Monoisotopic mass329.155273 Da
  • ChemSpider ID8671989

  • defined stereocentres - 5 of 5 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(5α,6α)-6-Hydroxy-17-methyl(1-3H)-7,8-didehydro-4,5-epoxymorphinan-3-yl acetate [ACD/IUPAC Name]
(5α,6α)-6-Hydroxy-17-methyl(1-3H)-7,8-didehydro-4,5-epoxymorphinan-3-yl-acetat [German] [ACD/IUPAC Name]
Acétate de (5α,6α)-6-hydroxy-17-méthyl(1-3H)-7,8-didéhydro-4,5-époxymorphinane-3-yle [French] [ACD/IUPAC Name]
Morphinan-1-t-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl-, 3-acetate, (5α,6α)- [ACD/Index Name]

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

Density:
Boiling Point: 495.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.3±3.0 kJ/mol
Flash Point: 253.1±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.62
ACD/LogD (pH 5.5): -1.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.62
Polar Surface Area: 59 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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