ChemSpider 2D Image | (2R,3R)-2-(2-Chlorophenyl)-1-ethyl-5-oxo-3-pyrrolidinecarboxylic acid | C13H14ClNO3

(2R,3R)-2-(2-Chlorophenyl)-1-ethyl-5-oxo-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC13H14ClNO3
  • Average mass267.708 Da
  • Monoisotopic mass267.066223 Da
  • ChemSpider ID17920559

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3R)-2-(2-Chlorophenyl)-1-ethyl-5-oxo-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
(2R,3R)-2-(2-chlorophenyl)-1-ethyl-5-oxopyrrolidine-3-carboxylic acid
(2R,3R)-2-(2-Chlorphenyl)-1-ethyl-5-oxo-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
1175848-28-8 [RN]
3-Pyrrolidinecarboxylic acid, 2-(2-chlorophenyl)-1-ethyl-5-oxo-, (2R,3R)- [ACD/Index Name]
Acide (2R,3R)-2-(2-chlorophényl)-1-éthyl-5-oxo-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
(2R,3R)-2-(2-Chlorophenyl)-1-ethyl-5-oxo
(2R,3R)-2-(2-Chlorophenyl)-1-ethyl-5-oxo pyrrolidine-3-carboxylic acid
(2R,3R)-2-(2-Chloro-phenyl)-1-ethyl-5-oxo-pyrrolidine-3-carboxylic acid
(2r,3r)-2-(2-chloro-phenyl)-1-ethyl-5-oxo-pyrrolidine-3-carboxylicacid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD08687456 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 465.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 235.2±28.7 °C
Index of Refraction: 1.576
Molar Refractivity: 66.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.02
ACD/LogD (pH 5.5): 0.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.44
ACD/LogD (pH 7.4): -1.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 202.2±3.0 cm3

Click to predict properties on the Chemicalize site


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