ChemSpider 2D Image | 1-{2-Hydroxy-2-[4-(trifluoromethoxy)phenyl]ethyl}-5-nitro-2(1H)-pyridinone | C14H11F3N2O5

1-{2-Hydroxy-2-[4-(trifluoromethoxy)phenyl]ethyl}-5-nitro-2(1H)-pyridinone

  • Molecular FormulaC14H11F3N2O5
  • Average mass344.243 Da
  • Monoisotopic mass344.062012 Da
  • ChemSpider ID29812346

More details:






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

1-{2-Hydroxy-2-[4-(trifluormethoxy)phenyl]ethyl}-5-nitro-2(1H)-pyridinon [German] [ACD/IUPAC Name]
1-{2-Hydroxy-2-[4-(trifluoromethoxy)phenyl]ethyl}-5-nitro-2(1H)-pyridinone [ACD/IUPAC Name]
1-{2-Hydroxy-2-[4-(trifluorométhoxy)phényl]éthyl}-5-nitro-2(1H)-pyridinone [French] [ACD/IUPAC Name]
2(1H)-Pyridinone, 1-[2-hydroxy-2-[4-(trifluoromethoxy)phenyl]ethyl]-5-nitro- [ACD/Index Name]
1-{2-HYDROXY-2-[4-(TRIFLUOROMETHOXY)PHENYL]ETHYL}-5-NITROPYRIDIN-2-ONE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 478.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.2±3.0 kJ/mol
Flash Point: 243.1±28.7 °C
Index of Refraction: 1.585
Molar Refractivity: 75.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.45
ACD/LogD (pH 5.5): 1.29
ACD/BCF (pH 5.5): 5.66
ACD/KOC (pH 5.5): 120.43
ACD/LogD (pH 7.4): 1.29
ACD/BCF (pH 7.4): 5.66
ACD/KOC (pH 7.4): 120.43
Polar Surface Area: 96 Å2
Polarizability: 29.7±0.5 10-24cm3
Surface Tension: 56.4±5.0 dyne/cm
Molar Volume: 223.9±5.0 cm3

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