ChemSpider 2D Image | (2R,3R)-1-Ethyl-2-(2-fluorophenyl)-6-oxo-3-piperidinecarboxylic acid | C14H16FNO3

(2R,3R)-1-Ethyl-2-(2-fluorophenyl)-6-oxo-3-piperidinecarboxylic acid

  • Molecular FormulaC14H16FNO3
  • Average mass265.280 Da
  • Monoisotopic mass265.111420 Da
  • ChemSpider ID17920763

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3R)-1-Ethyl-2-(2-fluorophenyl)-6-oxo-3-piperidinecarboxylic acid [ACD/IUPAC Name]
(2R,3R)-1-ethyl-2-(2-fluorophenyl)-6-oxopiperidine-3-carboxylic acid
(2R,3R)-1-Ethyl-2-(2-fluorphenyl)-6-oxo-3-piperidincarbonsäure [German] [ACD/IUPAC Name]
1175673-04-7 [RN]
3-Piperidinecarboxylic acid, 1-ethyl-2-(2-fluorophenyl)-6-oxo-, (2R,3R)- [ACD/Index Name]
Acide (2R,3R)-1-éthyl-2-(2-fluorophényl)-6-oxo-3-pipéridinecarboxylique [French] [ACD/IUPAC Name]
(2R,3R)-1-Ethyl-2-(2-fluoro-phenyl)-6-oxo-piperidine-3-carboxylic acid
(2r,3r)-1-ethyl-2-(2-fluoro-phenyl)-6-oxo-piperidine-3-carboxylicacid
MFCD08690223 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 447.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 224.5±28.7 °C
Index of Refraction: 1.540
Molar Refractivity: 66.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.83
ACD/LogD (pH 5.5): 0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.79
ACD/LogD (pH 7.4): -1.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 212.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement