ChemSpider 2D Image | 1-(2-Hydroxy-3-isopropoxypropyl)-3-(trifluoromethyl)-2(1H)-pyridinone | C12H16F3NO3

1-(2-Hydroxy-3-isopropoxypropyl)-3-(trifluoromethyl)-2(1H)-pyridinone

  • Molecular FormulaC12H16F3NO3
  • Average mass279.255 Da
  • Monoisotopic mass279.108215 Da
  • ChemSpider ID35160046

More details:

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

1-(2-Hydroxy-3-isopropoxypropyl)-3-(trifluormethyl)-2(1H)-pyridinon [German] [ACD/IUPAC Name]
1-(2-Hydroxy-3-isopropoxypropyl)-3-(trifluoromethyl)-2(1H)-pyridinone [ACD/IUPAC Name]
1-(2-Hydroxy-3-isopropoxypropyl)-3-(trifluorométhyl)-2(1H)-pyridinone [French] [ACD/IUPAC Name]
2(1H)-Pyridinone, 1-[2-hydroxy-3-(1-methylethoxy)propyl]-3-(trifluoromethyl)- [ACD/Index Name]
1-(2-HYDROXY-3-ISOPROPOXYPROPYL)-3-(TRIFLUOROMETHYL)PYRIDIN-2-ONE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 378.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 72.5±6.0 kJ/mol
Flash Point: 182.9±27.9 °C
Index of Refraction: 1.474
Molar Refractivity: 61.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.45
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 8.19
ACD/KOC (pH 5.5): 156.75
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 8.19
ACD/KOC (pH 7.4): 156.75
Polar Surface Area: 50 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 36.7±3.0 dyne/cm
Molar Volume: 219.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement