Found 31 results

Search term: MF = 'C_{27}H_{23}ClF_{3}N_{3}O'
ChemSpider 2D Image | 1-(4-Chlorobenzyl)-5-(3,4-dimethylphenyl)-N-[3-(trifluoromethyl)benzyl]-1H-pyrazole-3-carboxamide | C27H23ClF3N3O

1-(4-Chlorobenzyl)-5-(3,4-dimethylphenyl)-N-[3-(trifluoromethyl)benzyl]-1H-pyrazole-3-carboxamide

  • Molecular FormulaC27H23ClF3N3O
  • Average mass497.939 Da
  • Monoisotopic mass497.148163 Da
  • ChemSpider ID67564915

More details:

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

1-(4-Chlorbenzyl)-5-(3,4-dimethylphenyl)-N-[3-(trifluormethyl)benzyl]-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
1-(4-Chlorobenzyl)-5-(3,4-dimethylphenyl)-N-[3-(trifluoromethyl)benzyl]-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
1-(4-Chlorobenzyl)-5-(3,4-diméthylphényl)-N-[3-(trifluorométhyl)benzyl]-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
1H-Pyrazole-3-carboxamide, 1-[(4-chlorophenyl)methyl]-5-(3,4-dimethylphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]- [ACD/Index 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: 637.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.2±3.0 kJ/mol
Flash Point: 339.6±31.5 °C
Index of Refraction: 1.589
Molar Refractivity: 132.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.30
ACD/LogD (pH 5.5): 6.43
ACD/BCF (pH 5.5): 45159.28
ACD/KOC (pH 5.5): 74722.30
ACD/LogD (pH 7.4): 6.43
ACD/BCF (pH 7.4): 45159.23
ACD/KOC (pH 7.4): 74722.23
Polar Surface Area: 47 Å2
Polarizability: 52.4±0.5 10-24cm3
Surface Tension: 40.1±7.0 dyne/cm
Molar Volume: 391.8±7.0 cm3

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