ChemSpider 2D Image | 3-[(2S,3S)-8-Methyl-3-phenyl-8-azabicyclo[3.2.1]oct-2-yl]-1-propanol | C17H25NO

3-[(2S,3S)-8-Methyl-3-phenyl-8-azabicyclo[3.2.1]oct-2-yl]-1-propanol

  • Molecular FormulaC17H25NO
  • Average mass259.387 Da
  • Monoisotopic mass259.193604 Da
  • ChemSpider ID23211093

  • defined stereocentres - 2 of 4 defined stereocentres

More details:

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

3-[(2S,3S)-8-Methyl-3-phenyl-8-azabicyclo[3.2.1]oct-2-yl]-1-propanol [German] [ACD/IUPAC Name]
3-[(2S,3S)-8-Methyl-3-phenyl-8-azabicyclo[3.2.1]oct-2-yl]-1-propanol [ACD/IUPAC Name]
3-[(2S,3S)-8-Méthyl-3-phényl-8-azabicyclo[3.2.1]oct-2-yl]-1-propanol [French] [ACD/IUPAC Name]
3-[(2S,3S)-8-methyl-3-phenyl-8-azabicyclo[3.2.1]oct-2-yl]propan-1-ol
8-Azabicyclo[3.2.1]octane-2-propanol, 8-methyl-3-phenyl-, (2S,3S)- [ACD/Index Name]
3-(8-Methyl-3-phenyl-8-aza-bicyclo[3.2.1]oct-2-yl)-propan-1-ol
3-[(2S,3S)-8-methyl-3-phenyl-8-azabicyclo[3.2.1]octan-2-yl]propan-1-ol
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL423162/

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

Density: 1.0±0.1 g/cm3
Boiling Point: 382.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.5±3.0 kJ/mol
Flash Point: 175.2±24.6 °C
Index of Refraction: 1.541
Molar Refractivity: 78.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.37
ACD/LogD (pH 5.5): -0.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 23 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 38.1±3.0 dyne/cm
Molar Volume: 249.8±3.0 cm3

Click to predict properties on the Chemicalize site


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