Found 126 results

Search term: C18H12F5N3O (Found by molecular formula)
ChemSpider 2D Image | N-(2,6-Difluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxamide | C18H12F5N3O

N-(2,6-Difluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxamide

  • Molecular FormulaC18H12F5N3O
  • Average mass381.299 Da
  • Monoisotopic mass381.090057 Da
  • ChemSpider ID23165495

More details:

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

1H-Pyrazole-3-carboxamide, N-(2,6-difluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
N-(2,6-Difluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
N-(2,6-Difluorophényl)-5-méthyl-1-[3-(trifluorométhyl)phényl]-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
N-(2,6-Difluorphenyl)-5-methyl-1-[3-(trifluormethyl)phenyl]-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
5-Methyl-1-(3-trifluoromethyl-phenyl)-1H-pyrazole-3-carboxylic acid (2,6-difluoro-phenyl)-amide
CHEMBL440310
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL440310/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 378.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.7±3.0 kJ/mol
Flash Point: 182.9±27.9 °C
Index of Refraction: 1.561
Molar Refractivity: 88.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 3.89
ACD/BCF (pH 5.5): 529.62
ACD/KOC (pH 5.5): 3100.33
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 527.13
ACD/KOC (pH 7.4): 3085.77
Polar Surface Area: 47 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 36.7±7.0 dyne/cm
Molar Volume: 273.2±7.0 cm3

Click to predict properties on the Chemicalize site


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