ChemSpider 2D Image | Benzyl (2R)-2-ethyl-4-oxo-3,4-dihydro-1(2H)-pyridinecarboxylate | C15H17NO3

Benzyl (2R)-2-ethyl-4-oxo-3,4-dihydro-1(2H)-pyridinecarboxylate

  • Molecular FormulaC15H17NO3
  • Average mass259.300 Da
  • Monoisotopic mass259.120850 Da
  • ChemSpider ID28416691

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-Éthyl-4-oxo-3,4-dihydro-1(2H)-pyridinecarboxylate de benzyle [French] [ACD/IUPAC Name]
1(2H)-Pyridinecarboxylic acid, 2-ethyl-3,4-dihydro-4-oxo-, phenylmethyl ester, (2R)- [ACD/Index Name]
Benzyl (2R)-2-ethyl-4-oxo-3,4-dihydro-1(2H)-pyridinecarboxylate [ACD/IUPAC Name]
Benzyl-(2R)-2-ethyl-4-oxo-3,4-dihydro-1(2H)-pyridincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 398.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.9±3.0 kJ/mol
Flash Point: 194.8±27.9 °C
Index of Refraction: 1.550
Molar Refractivity: 71.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.07
ACD/LogD (pH 5.5): 2.43
ACD/BCF (pH 5.5): 41.68
ACD/KOC (pH 5.5): 502.55
ACD/LogD (pH 7.4): 2.43
ACD/BCF (pH 7.4): 41.68
ACD/KOC (pH 7.4): 502.55
Polar Surface Area: 47 Å2
Polarizability: 28.2±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 223.2±3.0 cm3

Click to predict properties on the Chemicalize site


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