ChemSpider 2D Image | naloxol | C19H23NO4

naloxol

  • Molecular FormulaC19H23NO4
  • Average mass329.390 Da
  • Monoisotopic mass329.162720 Da
  • ChemSpider ID34981129
  • defined stereocentres - 4 of 5 defined stereocentres


More details:



Featured data source



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

(5α)-17-Allyl-4,5-epoxymorphinan-3,6,14-triol [German] [ACD/IUPAC Name]
(5α)-17-Allyl-4,5-epoxymorphinan-3,6,14-triol [ACD/IUPAC Name]
(5α)-17-Allyl-4,5-époxymorphinane-3,6,14-triol [French] [ACD/IUPAC Name]
58691-01-3 [RN]
Morphinan-3,6,14-triol, 4,5-epoxy-17-(2-propen-1-yl)-, (5α)- [ACD/Index Name]
N-allyl-7,8-dihydro-14-hydroxynormorphine
naloxol

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

Density: 1.4±0.1 g/cm3
Boiling Point: 532.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.1±3.0 kJ/mol
Flash Point: 275.8±30.1 °C
Index of Refraction: 1.701
Molar Refractivity: 88.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.88
ACD/LogD (pH 5.5): -0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.28
ACD/LogD (pH 7.4): 1.19
ACD/BCF (pH 7.4): 4.41
ACD/KOC (pH 7.4): 93.45
Polar Surface Area: 73 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 75.0±5.0 dyne/cm
Molar Volume: 229.2±5.0 cm3

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