ChemSpider 2D Image | 5,7-Difluoro-2-methyl-3-{4-[4-(trifluoromethoxy)phenoxy]phenyl}-4(1H)-quinolinone | C23H14F5NO3

5,7-Difluoro-2-methyl-3-{4-[4-(trifluoromethoxy)phenoxy]phenyl}-4(1H)-quinolinone

  • Molecular FormulaC23H14F5NO3
  • Average mass447.354 Da
  • Monoisotopic mass447.089386 Da
  • ChemSpider ID58929853

More details:

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

4(1H)-Quinolinone, 5,7-difluoro-2-methyl-3-[4-[4-(trifluoromethoxy)phenoxy]phenyl]- [ACD/Index Name]
5,7-Difluor-2-methyl-3-{4-[4-(trifluormethoxy)phenoxy]phenyl}-4(1H)-chinolinon [German] [ACD/IUPAC Name]
5,7-Difluoro-2-méthyl-3-{4-[4-(trifluorométhoxy)phénoxy]phényl}-4(1H)-quinoléinone [French] [ACD/IUPAC Name]
5,7-Difluoro-2-methyl-3-{4-[4-(trifluoromethoxy)phenoxy]phenyl}-4(1H)-quinolinone [ACD/IUPAC Name]
MMV671636

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

Density: 1.4±0.1 g/cm3
Boiling Point: 484.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±3.0 kJ/mol
Flash Point: 246.6±28.7 °C
Index of Refraction: 1.561
Molar Refractivity: 104.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 8.74
ACD/LogD (pH 5.5): 6.91
ACD/BCF (pH 5.5): 105415.71
ACD/KOC (pH 5.5): 137079.92
ACD/LogD (pH 7.4): 6.91
ACD/BCF (pH 7.4): 105416.29
ACD/KOC (pH 7.4): 137080.67
Polar Surface Area: 48 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 40.1±3.0 dyne/cm
Molar Volume: 321.6±3.0 cm3

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