ChemSpider 2D Image | 2-[5-Hydroxy-4-(methylsulfonyl)-1H-pyrazol-1-yl]-6-(trifluoromethyl)-4-pyridinol | C10H8F3N3O4S

2-[5-Hydroxy-4-(methylsulfonyl)-1H-pyrazol-1-yl]-6-(trifluoromethyl)-4-pyridinol

  • Molecular FormulaC10H8F3N3O4S
  • Average mass323.248 Da
  • Monoisotopic mass323.018768 Da
  • ChemSpider ID116963078

More details:

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

2-[5-Hydroxy-4-(methylsulfonyl)-1H-pyrazol-1-yl]-6-(trifluormethyl)-4-pyridinol [German] [ACD/IUPAC Name]
2-[5-Hydroxy-4-(methylsulfonyl)-1H-pyrazol-1-yl]-6-(trifluoromethyl)-4-pyridinol [ACD/IUPAC Name]
2-[5-Hydroxy-4-(méthylsulfonyl)-1H-pyrazol-1-yl]-6-(trifluorométhyl)-4-pyridinol [French] [ACD/IUPAC Name]
4-Pyridinol, 2-[5-hydroxy-4-(methylsulfonyl)-1H-pyrazol-1-yl]-6-(trifluoromethyl)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 676.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.8±3.0 kJ/mol
Flash Point: 362.6±31.5 °C
Index of Refraction: 1.621
Molar Refractivity: 65.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.98
ACD/LogD (pH 5.5): -1.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 114 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 55.6±7.0 dyne/cm
Molar Volume: 184.9±7.0 cm3

Click to predict properties on the Chemicalize site


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