ChemSpider 2D Image | 1-(4-Methoxyphenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)-1H-pyrazole | C17H20BF3N2O3

1-(4-Methoxyphenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)-1H-pyrazole

  • Molecular FormulaC17H20BF3N2O3
  • Average mass368.159 Da
  • Monoisotopic mass368.151917 Da
  • ChemSpider ID30653581

More details:

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

1-(4-Methoxyphenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluormethyl)-1H-pyrazol [German] [ACD/IUPAC Name]
1-(4-Methoxyphenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)-1H-pyrazole [ACD/IUPAC Name]
1-(4-Méthoxyphényl)-5-(4,4,5,5-tétraméthyl-1,3,2-dioxaborolan-2-yl)-3-(trifluorométhyl)-1H-pyrazole [French] [ACD/IUPAC Name]
1H-Pyrazole, 1-(4-methoxyphenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 431.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.1±3.0 kJ/mol
Flash Point: 215.0±28.7 °C
Index of Refraction: 1.507
Molar Refractivity: 89.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 46 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 32.3±7.0 dyne/cm
Molar Volume: 301.1±7.0 cm3

Click to predict properties on the Chemicalize site


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