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ChemSpider 2D Image | 6-Hydroxy-17-methyl-7,8-didehydro-4,5-epoxymorphinan-3-yl 1-naphthoate | C28H25NO4

6-Hydroxy-17-methyl-7,8-didehydro-4,5-epoxymorphinan-3-yl 1-naphthoate

  • Molecular FormulaC28H25NO4
  • Average mass439.502 Da
  • Monoisotopic mass439.178345 Da
  • ChemSpider ID30650491

  • defined stereocentres - 2 of 5 defined stereocentres

More details:

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

1-Naphthalenecarboxylic acid, 7,8-didehydro-4,5-epoxy-6-hydroxy-17-methylmorphinan-3-yl ester [ACD/Index Name]
1-Naphtoate de 6-hydroxy-17-méthyl-7,8-didéhydro-4,5-époxymorphinane-3-yle [French] [ACD/IUPAC Name]
6-Hydroxy-17-methyl-7,8-didehydro-4,5-epoxymorphinan-3-yl 1-naphthoate [ACD/IUPAC Name]
6-Hydroxy-17-methyl-7,8-didehydro-4,5-epoxymorphinan-3-yl-1-naphthoat [German] [ACD/IUPAC 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: 669.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 103.4±3.0 kJ/mol
Flash Point: 358.8±31.5 °C
Index of Refraction: 1.738
Molar Refractivity: 125.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.99
ACD/LogD (pH 5.5): 1.21
ACD/BCF (pH 5.5): 1.21
ACD/KOC (pH 5.5): 7.51
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 59.78
ACD/KOC (pH 7.4): 372.33
Polar Surface Area: 59 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 71.5±5.0 dyne/cm
Molar Volume: 311.1±5.0 cm3

Click to predict properties on the Chemicalize site


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