ChemSpider 2D Image | 4-Benzoyl-N-(3-chlorobenzyl)-5-methyl-1-(4-methylbenzyl)-1H-pyrrole-2-carboxamide | C28H25ClN2O2

4-Benzoyl-N-(3-chlorobenzyl)-5-methyl-1-(4-methylbenzyl)-1H-pyrrole-2-carboxamide

  • Molecular FormulaC28H25ClN2O2
  • Average mass456.963 Da
  • Monoisotopic mass456.160461 Da
  • ChemSpider ID30818224

More details:

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

1H-Pyrrole-2-carboxamide, 4-benzoyl-N-[(3-chlorophenyl)methyl]-5-methyl-1-[(4-methylphenyl)methyl]- [ACD/Index Name]
4-Benzoyl-N-(3-chlorbenzyl)-5-methyl-1-(4-methylbenzyl)-1H-pyrrol-2-carboxamid [German] [ACD/IUPAC Name]
4-Benzoyl-N-(3-chlorobenzyl)-5-methyl-1-(4-methylbenzyl)-1H-pyrrole-2-carboxamide [ACD/IUPAC Name]
4-Benzoyl-N-(3-chlorobenzyl)-5-méthyl-1-(4-méthylbenzyl)-1H-pyrrole-2-carboxamide [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: 612.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.9±3.0 kJ/mol
Flash Point: 324.1±31.5 °C
Index of Refraction: 1.612
Molar Refractivity: 134.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.97
ACD/LogD (pH 5.5): 5.99
ACD/BCF (pH 5.5): 21031.55
ACD/KOC (pH 5.5): 43241.14
ACD/LogD (pH 7.4): 5.99
ACD/BCF (pH 7.4): 21031.55
ACD/KOC (pH 7.4): 43241.14
Polar Surface Area: 51 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 44.0±7.0 dyne/cm
Molar Volume: 386.5±7.0 cm3

Click to predict properties on the Chemicalize site


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