ChemSpider 2D Image | N-Desmethyltramadol | C15H23NO2

N-Desmethyltramadol

  • Molecular FormulaC15H23NO2
  • Average mass249.349 Da
  • Monoisotopic mass249.172882 Da
  • ChemSpider ID23935864
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(1R,2R)-1-(3-Methoxyphenyl)-2-[(methylamino)methyl]cyclohexanol [ACD/IUPAC Name]
(1R,2R)-1-(3-Methoxyphenyl)-2-[(methylamino)methyl]cyclohexanol [German] [ACD/IUPAC Name]
(1R,2R)-1-(3-Méthoxyphényl)-2-[(méthylamino)méthyl]cyclohexanol [French] [ACD/IUPAC Name]
75377-45-6 [RN]
Cyclohexanol, 1-(3-methoxyphenyl)-2-[(methylamino)methyl]-, (1R,2R)- [ACD/Index Name]
N-Desmethyltramadol
(-)-N-Desmethyl Tramadol
(-)-N-DesmethylTramadol
(+)-N-Desmethyl Tramadol
(+)-N-Desmethyl Tramadol-d3
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 389.5±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.4±3.0 kJ/mol
Flash Point: 189.4±22.3 °C
Index of Refraction: 1.531
Molar Refractivity: 73.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.02
ACD/LogD (pH 5.5): -0.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 41 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 39.7±3.0 dyne/cm
Molar Volume: 236.4±3.0 cm3

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