ChemSpider 2D Image | 3-[5-Hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-3-yl]-4,6-dimethyl-2(1H)-pyridinone | C11H12F3N3O2

3-[5-Hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-3-yl]-4,6-dimethyl-2(1H)-pyridinone

  • Molecular FormulaC11H12F3N3O2
  • Average mass275.227 Da
  • Monoisotopic mass275.088165 Da
  • ChemSpider ID21542257

More details:






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

2(1H)-Pyridinone, 3-[4,5-dihydro-5-hydroxy-5-(trifluoromethyl)-1H-pyrazol-3-yl]-4,6-dimethyl- [ACD/Index Name]
3-[5-Hydroxy-5-(trifluormethyl)-4,5-dihydro-1H-pyrazol-3-yl]-4,6-dimethyl-2(1H)-pyridinon [German] [ACD/IUPAC Name]
3-[5-Hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-3-yl]-4,6-dimethyl-2(1H)-pyridinone [ACD/IUPAC Name]
3-[5-Hydroxy-5-(trifluorométhyl)-4,5-dihydro-1H-pyrazol-3-yl]-4,6-diméthyl-2(1H)-pyridinone [French] [ACD/IUPAC Name]
3-(5-Hydroxy-5-trifluoromethyl-4,5-dihydro-1H-pyrazol-3-yl)-4,6-dimethyl-1H-pyridin-2-one
3-[5-hydroxy-5-(trifluoromethyl)(2-pyrazolin-3-yl)]-4,6-dimethylhydropyridin-2-one
3-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-3-yl]-4,6-dimethylpyridin-2(1H)-one

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.576
Molar Refractivity: 59.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.76
ACD/LogD (pH 5.5): 0.61
ACD/BCF (pH 5.5): 1.71
ACD/KOC (pH 5.5): 51.13
ACD/LogD (pH 7.4): 0.61
ACD/BCF (pH 7.4): 1.71
ACD/KOC (pH 7.4): 50.93
Polar Surface Area: 74 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 41.8±7.0 dyne/cm
Molar Volume: 179.1±7.0 cm3

Click to predict properties on the Chemicalize site






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