ChemSpider 2D Image | Methyl 1-(5-nitro-2-pyridinyl)-D-prolinate | C11H13N3O4

Methyl 1-(5-nitro-2-pyridinyl)-D-prolinate

  • Molecular FormulaC11H13N3O4
  • Average mass251.239 Da
  • Monoisotopic mass251.090607 Da
  • ChemSpider ID21474497

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-(5-Nitro-2-pyridinyl)-D-prolinate de méthyle [French] [ACD/IUPAC Name]
D-Proline, 1-(5-nitro-2-pyridinyl)-, methyl ester [ACD/Index Name]
Methyl 1-(5-nitro-2-pyridinyl)-D-prolinate [ACD/IUPAC Name]
Methyl-1-(5-nitro-2-pyridinyl)-D-prolinat [German] [ACD/IUPAC Name]
Methyl (2S)-1-(5-nitropyridin-2-yl)pyrrolidine-2-carboxylate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 418.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.2±3.0 kJ/mol
Flash Point: 206.9±28.7 °C
Index of Refraction: 1.579
Molar Refractivity: 62.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.34
ACD/LogD (pH 5.5): 1.67
ACD/BCF (pH 5.5): 10.97
ACD/KOC (pH 5.5): 193.11
ACD/LogD (pH 7.4): 1.67
ACD/BCF (pH 7.4): 11.01
ACD/KOC (pH 7.4): 193.75
Polar Surface Area: 88 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 58.9±3.0 dyne/cm
Molar Volume: 186.6±3.0 cm3

Click to predict properties on the Chemicalize site


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