ChemSpider 2D Image | 3,5-Difluoro-N-{5-methyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-4-yl}benzamide | C18H12F5N3O

3,5-Difluoro-N-{5-methyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-4-yl}benzamide

  • Molecular FormulaC18H12F5N3O
  • Average mass381.299 Da
  • Monoisotopic mass381.090057 Da
  • ChemSpider ID22725040

More details:

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

3,5-Difluor-N-{5-methyl-3-[4-(trifluormethyl)phenyl]-1H-pyrazol-4-yl}benzamid [German] [ACD/IUPAC Name]
3,5-Difluoro-N-{5-methyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-4-yl}benzamide [ACD/IUPAC Name]
3,5-Difluoro-N-{5-méthyl-3-[4-(trifluorométhyl)phényl]-1H-pyrazol-4-yl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 3,5-difluoro-N-[5-methyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-4-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 422.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.6±3.0 kJ/mol
Flash Point: 209.2±28.7 °C
Index of Refraction: 1.581
Molar Refractivity: 87.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.04
ACD/LogD (pH 5.5): 4.43
ACD/BCF (pH 5.5): 1379.29
ACD/KOC (pH 5.5): 6150.88
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1379.55
ACD/KOC (pH 7.4): 6152.03
Polar Surface Area: 58 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 263.3±3.0 cm3

Click to predict properties on the Chemicalize site


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