ChemSpider 2D Image | (1R)-2-[(Dimethylamino)methyl]-1-(3-methoxyphenyl)cyclohexanol | C16H25NO2

(1R)-2-[(Dimethylamino)methyl]-1-(3-methoxyphenyl)cyclohexanol

  • Molecular FormulaC16H25NO2
  • Average mass263.375 Da
  • Monoisotopic mass263.188538 Da
  • ChemSpider ID26402668

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(1R)-2-[(Dimethylamino)methyl]-1-(3-methoxyphenyl)cyclohexanol [German] [ACD/IUPAC Name]
(1R)-2-[(Dimethylamino)methyl]-1-(3-methoxyphenyl)cyclohexanol [ACD/IUPAC Name]
(1R)-2-[(Diméthylamino)méthyl]-1-(3-méthoxyphényl)cyclohexanol [French] [ACD/IUPAC Name]
Cyclohexanol, 2-[(dimethylamino)methyl]-1-(3-methoxyphenyl)-, (1R)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 388.1±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.2±3.0 kJ/mol
Flash Point: 188.5±22.3 °C
Index of Refraction: 1.533
Molar Refractivity: 78.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.51
ACD/LogD (pH 5.5): -0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.45
Polar Surface Area: 33 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 39.7±3.0 dyne/cm
Molar Volume: 251.4±3.0 cm3

Click to predict properties on the Chemicalize site


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