ChemSpider 2D Image | 2-{3,5-Dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrazol-4-yl}-N-(3-fluorobenzyl)-N-methyl-2-oxoacetamide | C22H19F4N3O2

2-{3,5-Dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrazol-4-yl}-N-(3-fluorobenzyl)-N-methyl-2-oxoacetamide

  • Molecular FormulaC22H19F4N3O2
  • Average mass433.399 Da
  • Monoisotopic mass433.141327 Da
  • ChemSpider ID22076504

More details:

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

1H-Pyrazole-4-acetamide, N-[(3-fluorophenyl)methyl]-N,3,5-trimethyl-α-oxo-1-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
2-{3,5-Dimethyl-1-[3-(trifluormethyl)phenyl]-1H-pyrazol-4-yl}-N-(3-fluorbenzyl)-N-methyl-2-oxoacetamid [German] [ACD/IUPAC Name]
2-{3,5-Dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrazol-4-yl}-N-(3-fluorobenzyl)-N-methyl-2-oxoacetamide [ACD/IUPAC Name]
2-{3,5-Diméthyl-1-[3-(trifluorométhyl)phényl]-1H-pyrazol-4-yl}-N-(3-fluorobenzyl)-N-méthyl-2-oxoacétamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 531.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.7±3.0 kJ/mol
Flash Point: 275.3±32.9 °C
Index of Refraction: 1.558
Molar Refractivity: 108.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 849.16
ACD/KOC (pH 5.5): 4346.83
ACD/LogD (pH 7.4): 4.16
ACD/BCF (pH 7.4): 849.16
ACD/KOC (pH 7.4): 4346.83
Polar Surface Area: 55 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 37.5±7.0 dyne/cm
Molar Volume: 336.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement