ChemSpider 2D Image | Ethyl 8-chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydro-3-quinolinecarboxylate | C13H9ClF3NO3

Ethyl 8-chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydro-3-quinolinecarboxylate

  • Molecular FormulaC13H9ClF3NO3
  • Average mass319.664 Da
  • Monoisotopic mass319.022308 Da
  • ChemSpider ID62948953

More details:

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

3-Quinolinecarboxylic acid, 8-chloro-1,4-dihydro-4-oxo-5-(trifluoromethyl)-, ethyl ester [ACD/Index Name]
8-Chloro-4-oxo-5-(trifluorométhyl)-1,4-dihydro-3-quinoléinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 8-chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydro-3-quinolinecarboxylate [ACD/IUPAC Name]
Ethyl-8-chlor-4-oxo-5-(trifluormethyl)-1,4-dihydro-3-chinolincarboxylat [German] [ACD/IUPAC Name]
1221573-17-6 [RN]
Ethyl 8-chloro-4-hydroxy-5-(trifluoromethyl)quinoline-3-carboxylate
Ethyl 8-chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 383.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.2±3.0 kJ/mol
Flash Point: 185.5±27.9 °C
Index of Refraction: 1.522
Molar Refractivity: 67.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.51
ACD/LogD (pH 5.5): 3.92
ACD/BCF (pH 5.5): 557.40
ACD/KOC (pH 5.5): 3215.93
ACD/LogD (pH 7.4): 3.92
ACD/BCF (pH 7.4): 557.40
ACD/KOC (pH 7.4): 3215.93
Polar Surface Area: 55 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 40.7±3.0 dyne/cm
Molar Volume: 219.7±3.0 cm3

Click to predict properties on the Chemicalize site


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