ChemSpider 2D Image | (5beta,14beta,18R)-17-(Cyclopropylmethyl)-18-(2-hydroxy-2-propanyl)-6-methoxy-7,8-didehydro-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-3-ol | C26H33NO4

(5β,14β,18R)-17-(Cyclopropylmethyl)-18-(2-hydroxy-2-propanyl)-6-methoxy-7,8-didehydro-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-3-ol

  • Molecular FormulaC26H33NO4
  • Average mass423.544 Da
  • Monoisotopic mass423.240967 Da
  • ChemSpider ID32700249

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(5β,14β,18R)-17-(Cyclopropylmethyl)-18-(2-hydroxy-2-propanyl)-6-methoxy-7,8-didehydro-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-3-ol [ACD/IUPAC Name]
(5β,14β,18R)-17-(Cyclopropylmethyl)-18-(2-hydroxy-2-propanyl)-6-methoxy-7,8-didehydro-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-3-ol [German] [ACD/IUPAC Name]
(5β,14β,18R)-17-(Cyclopropylméthyl)-18-(2-hydroxy-2-propanyl)-6-méthoxy-7,8-didéhydro-18,19-dihydro-4,5-époxy-6,14-éthénomorphinane-3-ol [French] [ACD/IUPAC Name]
6,14-Ethenomorphinan-3-ol, 17-(cyclopropylmethyl)-7,8-didehydro-4,5-epoxy-18,19-dihydro-18-(1-hydroxy-1-methylethyl)-6-methoxy-, (5β,14β,18R)- [ACD/Index Name]
Cyprenorphine
UNII-1P6HEG5ZHS

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.674
Molar Refractivity: 117.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.06
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 1.12
ACD/KOC (pH 5.5): 8.83
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 54.60
ACD/KOC (pH 7.4): 432.03
Polar Surface Area: 62 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 65.0±5.0 dyne/cm
Molar Volume: 312.9±5.0 cm3

Click to predict properties on the Chemicalize site


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