ChemSpider 2D Image | 1-{2-[(3-Chloro-2,2-dimethylpropanoyl)amino]ethyl}-5-oxo-3-pyrrolidinecarboxylic acid | C12H19ClN2O4

1-{2-[(3-Chloro-2,2-dimethylpropanoyl)amino]ethyl}-5-oxo-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC12H19ClN2O4
  • Average mass290.743 Da
  • Monoisotopic mass290.103333 Da
  • ChemSpider ID32418781

More details:

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

1-{2-[(3-Chlor-2,2-dimethylpropanoyl)amino]ethyl}-5-oxo-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
1-{2-[(3-Chloro-2,2-dimethylpropanoyl)amino]ethyl}-5-oxo-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 1-[2-[(3-chloro-2,2-dimethyl-1-oxopropyl)amino]ethyl]-5-oxo- [ACD/Index Name]
Acide 1-{2-[(3-chloro-2,2-diméthylpropanoyl)amino]éthyl}-5-oxo-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 573.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.4 mmHg at 25°C
Enthalpy of Vaporization: 94.0±6.0 kJ/mol
Flash Point: 300.9±30.1 °C
Index of Refraction: 1.524
Molar Refractivity: 69.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.72
ACD/LogD (pH 5.5): -1.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.60
ACD/LogD (pH 7.4): -2.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 226.0±3.0 cm3

Click to predict properties on the Chemicalize site


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