ChemSpider 2D Image | 1-[2-(Dimethylamino)ethyl]-4-(2,5-dimethylbenzoyl)-3-hydroxy-5-(4-iodophenyl)-1,5-dihydro-2H-pyrrol-2-one | C23H25IN2O3

1-[2-(Dimethylamino)ethyl]-4-(2,5-dimethylbenzoyl)-3-hydroxy-5-(4-iodophenyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC23H25IN2O3
  • Average mass504.361 Da
  • Monoisotopic mass504.090973 Da
  • ChemSpider ID11966098

More details:

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

1-[2-(Dimethylamino)ethyl]-4-(2,5-dimethylbenzoyl)-3-hydroxy-5-(4-iodophenyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
1-[2-(Diméthylamino)éthyl]-4-(2,5-diméthylbenzoyl)-3-hydroxy-5-(4-iodophényl)-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
1-[2-(Dimethylamino)ethyl]-4-(2,5-dimethylbenzoyl)-3-hydroxy-5-(4-iodphenyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
2H-Pyrrol-2-one, 1-[2-(dimethylamino)ethyl]-4-(2,5-dimethylbenzoyl)-1,5-dihydro-3-hydroxy-5-(4-iodophenyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 624.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.1±3.0 kJ/mol
Flash Point: 331.2±31.5 °C
Index of Refraction: 1.648
Molar Refractivity: 122.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.90
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 1.50
ACD/KOC (pH 5.5): 8.89
ACD/LogD (pH 7.4): 1.35
ACD/BCF (pH 7.4): 1.56
ACD/KOC (pH 7.4): 9.28
Polar Surface Area: 61 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 55.4±3.0 dyne/cm
Molar Volume: 336.2±3.0 cm3

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