ChemSpider 2D Image | Cycloheptyl[(3R,4R)-4-hydroxy-4-(2-methoxyethyl)-3-methyl-1-piperidinyl]methanone | C17H31NO3

Cycloheptyl[(3R,4R)-4-hydroxy-4-(2-methoxyethyl)-3-methyl-1-piperidinyl]methanone

  • Molecular FormulaC17H31NO3
  • Average mass297.433 Da
  • Monoisotopic mass297.230408 Da
  • ChemSpider ID29729948

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Cycloheptyl[(3R,4R)-4-hydroxy-4-(2-methoxyethyl)-3-methyl-1-piperidinyl]methanon [German] [ACD/IUPAC Name]
Cycloheptyl[(3R,4R)-4-hydroxy-4-(2-methoxyethyl)-3-methyl-1-piperidinyl]methanone [ACD/IUPAC Name]
Cycloheptyl[(3R,4R)-4-hydroxy-4-(2-méthoxyéthyl)-3-méthyl-1-pipéridinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, cycloheptyl[(3R,4R)-4-hydroxy-4-(2-methoxyethyl)-3-methyl-1-piperidinyl]- [ACD/Index Name]
(3R*,4R*)-1-(cycloheptylcarbonyl)-4-(2-methoxyethyl)-3-methyl-4-piperidinol

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

Density: 1.0±0.1 g/cm3
Boiling Point: 440.1±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.5±6.0 kJ/mol
Flash Point: 220.0±24.6 °C
Index of Refraction: 1.497
Molar Refractivity: 83.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.33
ACD/LogD (pH 5.5): 2.47
ACD/BCF (pH 5.5): 44.27
ACD/KOC (pH 5.5): 524.69
ACD/LogD (pH 7.4): 2.47
ACD/BCF (pH 7.4): 44.27
ACD/KOC (pH 7.4): 524.69
Polar Surface Area: 50 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 39.3±3.0 dyne/cm
Molar Volume: 284.9±3.0 cm3

Click to predict properties on the Chemicalize site


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