ChemSpider 2D Image | (3R,4R)-1-[2-(4-Fluorophenoxy)ethyl]-4-(2-methoxyethyl)-3-methyl-4-piperidinol | C17H26FNO3

(3R,4R)-1-[2-(4-Fluorophenoxy)ethyl]-4-(2-methoxyethyl)-3-methyl-4-piperidinol

  • Molecular FormulaC17H26FNO3
  • Average mass311.392 Da
  • Monoisotopic mass311.189667 Da
  • ChemSpider ID29653924
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(3R,4R)-1-[2-(4-Fluorophenoxy)ethyl]-4-(2-methoxyethyl)-3-methyl-4-piperidinol [ACD/IUPAC Name]
(3R,4R)-1-[2-(4-Fluorophénoxy)éthyl]-4-(2-méthoxyéthyl)-3-méthyl-4-pipéridinol [French] [ACD/IUPAC Name]
(3R,4R)-1-[2-(4-Fluorphenoxy)ethyl]-4-(2-methoxyethyl)-3-methyl-4-piperidinol [German] [ACD/IUPAC Name]
4-Piperidinol, 1-[2-(4-fluorophenoxy)ethyl]-4-(2-methoxyethyl)-3-methyl-, (3R,4R)- [ACD/Index Name]
(3R*,4R*)-1-[2-(4-fluorophenoxy)ethyl]-4-(2-methoxyethyl)-3-methyl-4-piperidinol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 417.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.7±3.0 kJ/mol
Flash Point: 206.3±25.9 °C
Index of Refraction: 1.505
Molar Refractivity: 84.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.92
ACD/LogD (pH 5.5): -0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.63
Polar Surface Area: 42 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 37.3±3.0 dyne/cm
Molar Volume: 283.5±3.0 cm3

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