ChemSpider 2D Image | 17-(Cyclopropylmethyl)-3-hydroxy-4,14-dimethoxymorphinan-6-one | C22H29NO4

17-(Cyclopropylmethyl)-3-hydroxy-4,14-dimethoxymorphinan-6-one

  • Molecular FormulaC22H29NO4
  • Average mass371.470 Da
  • Monoisotopic mass371.209656 Da
  • ChemSpider ID23190359

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

17-(Cyclopropylmethyl)-3-hydroxy-4,14-dimethoxymorphinan-6-on [German] [ACD/IUPAC Name]
17-(Cyclopropylmethyl)-3-hydroxy-4,14-dimethoxymorphinan-6-one [ACD/IUPAC Name]
17-(Cyclopropylméthyl)-3-hydroxy-4,14-diméthoxymorphinane-6-one [French] [ACD/IUPAC Name]
Morphinan-6-one, 17-(cyclopropylmethyl)-3-hydroxy-4,14-dimethoxy- [ACD/Index Name]
17-cyclopropylmethyl-4-hydroxy-3,10-dimethoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-13-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 544.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.4±3.0 kJ/mol
Flash Point: 283.1±30.1 °C
Index of Refraction: 1.618
Molar Refractivity: 101.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.59
ACD/LogD (pH 7.4): 2.07
ACD/BCF (pH 7.4): 19.23
ACD/KOC (pH 7.4): 246.85
Polar Surface Area: 59 Å2
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 57.6±5.0 dyne/cm
Molar Volume: 290.1±5.0 cm3

Click to predict properties on the Chemicalize site


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