ChemSpider 2D Image | N-(3-Chloro-4-fluorophenyl)-7-methyl-2,5-dioxo-1,2,5,6,7,8-hexahydro-3-quinolinecarboxamide | C17H14ClFN2O3

N-(3-Chloro-4-fluorophenyl)-7-methyl-2,5-dioxo-1,2,5,6,7,8-hexahydro-3-quinolinecarboxamide

  • Molecular FormulaC17H14ClFN2O3
  • Average mass348.756 Da
  • Monoisotopic mass348.067688 Da
  • ChemSpider ID28620045

More details:

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

3-Quinolinecarboxamide, N-(3-chloro-4-fluorophenyl)-1,2,5,6,7,8-hexahydro-7-methyl-2,5-dioxo- [ACD/Index Name]
N-(3-Chlor-4-fluorphenyl)-7-methyl-2,5-dioxo-1,2,5,6,7,8-hexahydro-3-chinolincarboxamid [German] [ACD/IUPAC Name]
N-(3-Chloro-4-fluorophényl)-7-méthyl-2,5-dioxo-1,2,5,6,7,8-hexahydro-3-quinoléinecarboxamide [French] [ACD/IUPAC Name]
N-(3-Chloro-4-fluorophenyl)-7-methyl-2,5-dioxo-1,2,5,6,7,8-hexahydro-3-quinolinecarboxamide [ACD/IUPAC Name]
7-Methyl-2,5-dioxo-1,2,5,6,7,8-hexahydro-quinoline-3-carboxylic acid (3-chloro-4-fluoro-phenyl)-amide
N-(3-chloro-4-fluorophenyl)-7-methyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 612.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.9±3.0 kJ/mol
Flash Point: 324.0±31.5 °C
Index of Refraction: 1.625
Molar Refractivity: 85.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.40
ACD/LogD (pH 5.5): 2.10
ACD/BCF (pH 5.5): 23.35
ACD/KOC (pH 5.5): 331.93
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 23.17
ACD/KOC (pH 7.4): 329.32
Polar Surface Area: 75 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 57.3±5.0 dyne/cm
Molar Volume: 241.3±5.0 cm3

Click to predict properties on the Chemicalize site


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