ChemSpider 2D Image | (2S)-2-Ammonio-3-(2-oxo-1,2-dihydro-4-quinolinyl)propanoate | C12H12N2O3

(2S)-2-Ammonio-3-(2-oxo-1,2-dihydro-4-quinolinyl)propanoate

  • Molecular FormulaC12H12N2O3
  • Average mass232.235 Da
  • Monoisotopic mass232.084793 Da
  • ChemSpider ID32787125

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Ammonio-3-(2-oxo-1,2-dihydro-4-chinolinyl)propanoat [German] [ACD/IUPAC Name]
(2S)-2-Ammonio-3-(2-oxo-1,2-dihydro-4-quinoléinyl)propanoate [French] [ACD/IUPAC Name]
(2S)-2-Ammonio-3-(2-oxo-1,2-dihydro-4-quinolinyl)propanoate [ACD/IUPAC Name]
4-Quinolinepropanoic acid, α-amino-1,2-dihydro-2-oxo-, (αS)- [ACD/Index Name]
236751-04-5 [RN]

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

Density:
Boiling Point: 522.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 269.9±30.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.80
ACD/LogD (pH 5.5): -2.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 97 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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