ChemSpider 2D Image | Ethyl (3S,4S)-4-phenyl-3-piperidinecarboxylate | C14H19NO2

Ethyl (3S,4S)-4-phenyl-3-piperidinecarboxylate

  • Molecular FormulaC14H19NO2
  • Average mass233.306 Da
  • Monoisotopic mass233.141586 Da
  • ChemSpider ID23172861

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,4S)-4-Phényl-3-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
3-Piperidinecarboxylic acid, 4-phenyl-, ethyl ester, (3S,4S)- [ACD/Index Name]
Ethyl (3S,4S)-4-phenyl-3-piperidinecarboxylate [ACD/IUPAC Name]
ethyl (3S,4S)-4-phenylpiperidine-3-carboxylate
Ethyl-(3S,4S)-4-phenyl-3-piperidincarboxylat [German] [ACD/IUPAC Name]
(3R,4R)-ethyl 4-phenylpiperidine-3-carboxylate
(3S,4S)-4-Phenyl-piperidine-3-carboxylic acid ethyl ester
116140-26-2 [RN]
749192-64-1 [RN]
CHEMBL84999
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 337.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.1±3.0 kJ/mol
Flash Point: 158.0±27.9 °C
Index of Refraction: 1.514
Molar Refractivity: 66.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): -0.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.63
Polar Surface Area: 38 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 37.0±3.0 dyne/cm
Molar Volume: 220.8±3.0 cm3

Click to predict properties on the Chemicalize site


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