ChemSpider 2D Image | (3S)-3-Ethyl-4-hydroxy-7-methoxy-2-oxo-2,3-dihydroquinolinium | C12H14NO3

(3S)-3-Ethyl-4-hydroxy-7-methoxy-2-oxo-2,3-dihydroquinolinium

  • Molecular FormulaC12H14NO3
  • Average mass220.244 Da
  • Monoisotopic mass220.096817 Da
  • ChemSpider ID57563303

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Ethyl-4-hydroxy-7-methoxy-2-oxo-2,3-dihydrochinolinium [German] [ACD/IUPAC Name]
(3S)-3-Éthyl-4-hydroxy-7-méthoxy-2-oxo-2,3-dihydroquinoléinium [French] [ACD/IUPAC Name]
(3S)-3-Ethyl-4-hydroxy-7-methoxy-2-oxo-2,3-dihydroquinolinium [ACD/IUPAC Name]
2(3H)-Quinolinone, 3-ethyl-4-hydroxy-7-methoxy-, conjugate acid, (3S)- [ACD/Index Name]
(3S)-3-Ethyl-4-hydroxy-7-methoxy-2-oxo-2,3-dihydroquinolin-1-ium
22048-12-0 [RN]

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

Density:
Boiling Point: 405.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 76.0±6.0 kJ/mol
Flash Point: 199.2±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.03
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 4.15
ACD/KOC (pH 5.5): 96.18
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 2.74
ACD/KOC (pH 7.4): 63.56
Polar Surface Area: 61 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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