ChemSpider 2D Image | 1-Cyclohexyl-3-{[(1S,2R)-1-hydroxy-1-phenyl-2-propanyl]amino}-1-propanone | C18H27NO2

1-Cyclohexyl-3-{[(1S,2R)-1-hydroxy-1-phenyl-2-propanyl]amino}-1-propanone

  • Molecular FormulaC18H27NO2
  • Average mass289.413 Da
  • Monoisotopic mass289.204193 Da
  • ChemSpider ID78075807

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-Cyclohexyl-3-{[(1S,2R)-1-hydroxy-1-phenyl-2-propanyl]amino}-1-propanon [German] [ACD/IUPAC Name]
1-Cyclohexyl-3-{[(1S,2R)-1-hydroxy-1-phenyl-2-propanyl]amino}-1-propanone [ACD/IUPAC Name]
1-Cyclohexyl-3-{[(1S,2R)-1-hydroxy-1-phényl-2-propanyl]amino}-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-cyclohexyl-3-[[(1R,2S)-2-hydroxy-1-methyl-2-phenylethyl]amino]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 438.0±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 218.7±22.9 °C
Index of Refraction: 1.538
Molar Refractivity: 85.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.05
ACD/LogD (pH 5.5): 0.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.88
ACD/LogD (pH 7.4): 1.80
ACD/BCF (pH 7.4): 8.59
ACD/KOC (pH 7.4): 93.00
Polar Surface Area: 49 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 43.8±3.0 dyne/cm
Molar Volume: 271.9±3.0 cm3

Click to predict properties on the Chemicalize site


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