ChemSpider 2D Image | (+)-3-Methoxymorphinan | C17H23NO

(+)-3-Methoxymorphinan

  • Molecular FormulaC17H23NO
  • Average mass257.371 Da
  • Monoisotopic mass257.177979 Da
  • ChemSpider ID24693630

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(+)-3-Methoxymorphinan
(9α,13α,14α)-3-Methoxymorphinan [German] [ACD/IUPAC Name]
(9α,13α,14α)-3-Methoxymorphinan [ACD/IUPAC Name]
(9α,13α,14α)-3-Méthoxymorphinane [French] [ACD/IUPAC Name]
1531-23-3 [RN]
Morphinan, 3-methoxy-, (9α,13α,14α)- [ACD/Index Name]
(1S,9S,10S)-4-methoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene
28973-47-9 [RN]
3-METHOXYMORPHINAN, (+)-
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL1638/

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

SH6R750LWZ [DBID]
Lopac-M-187 [DBID]
NCGC00015637-01 [DBID]
UNII:SH6R750LWZ [DBID]
UNII-SH6R750LWZ [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 403.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.4±3.0 kJ/mol
Flash Point: 167.1±18.2 °C
Index of Refraction: 1.587
Molar Refractivity: 76.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.86
ACD/LogD (pH 5.5): 0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.50
ACD/LogD (pH 7.4): 0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.92
Polar Surface Area: 21 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 45.2±5.0 dyne/cm
Molar Volume: 228.7±5.0 cm3

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