ChemSpider 2D Image | N-(2-Methoxyethyl)-N-{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}-4-(trifluoromethyl)benzamide | C29H28F3N3O3

N-(2-Methoxyethyl)-N-{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}-4-(trifluoromethyl)benzamide

  • Molecular FormulaC29H28F3N3O3
  • Average mass523.546 Da
  • Monoisotopic mass523.208252 Da
  • ChemSpider ID22618275

More details:

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

Benzamide, N-(2-methoxyethyl)-N-[[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl]-4-(trifluoromethyl)- [ACD/Index Name]
N-(2-Methoxyethyl)-N-{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}-4-(trifluormethyl)benzamid [German] [ACD/IUPAC Name]
N-(2-Methoxyethyl)-N-{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}-4-(trifluoromethyl)benzamide [ACD/IUPAC Name]
N-(2-Méthoxyéthyl)-N-{[1-méthyl-5-(3-méthylphénoxy)-3-phényl-1H-pyrazol-4-yl]méthyl}-4-(trifluorométhyl)benzamide [French] [ACD/IUPAC 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: 647.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.4±3.0 kJ/mol
Flash Point: 345.2±31.5 °C
Index of Refraction: 1.561
Molar Refractivity: 140.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.81
ACD/LogD (pH 5.5): 5.56
ACD/BCF (pH 5.5): 9901.58
ACD/KOC (pH 5.5): 25217.55
ACD/LogD (pH 7.4): 5.56
ACD/BCF (pH 7.4): 9902.53
ACD/KOC (pH 7.4): 25219.96
Polar Surface Area: 57 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 38.8±7.0 dyne/cm
Molar Volume: 432.7±7.0 cm3

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