ChemSpider 2D Image | 4-(4-Chloro-3-methoxybenzoyl)-5-(2-fluorophenyl)-3-hydroxy-1-(2-isopropoxyethyl)-1,5-dihydro-2H-pyrrol-2-one | C23H23ClFNO5

4-(4-Chloro-3-methoxybenzoyl)-5-(2-fluorophenyl)-3-hydroxy-1-(2-isopropoxyethyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC23H23ClFNO5
  • Average mass447.884 Da
  • Monoisotopic mass447.124878 Da
  • ChemSpider ID34898147

More details:

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

2H-Pyrrol-2-one, 4-(4-chloro-3-methoxybenzoyl)-5-(2-fluorophenyl)-1,5-dihydro-3-hydroxy-1-[2-(1-methylethoxy)ethyl]- [ACD/Index Name]
4-(4-Chlor-3-methoxybenzoyl)-5-(2-fluorphenyl)-3-hydroxy-1-(2-isopropoxyethyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
4-(4-Chloro-3-methoxybenzoyl)-5-(2-fluorophenyl)-3-hydroxy-1-(2-isopropoxyethyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
4-(4-Chloro-3-méthoxybenzoyl)-5-(2-fluorophényl)-3-hydroxy-1-(2-isopropoxyéthyl)-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC 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: 604.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.5±3.0 kJ/mol
Flash Point: 319.5±31.5 °C
Index of Refraction: 1.590
Molar Refractivity: 113.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.62
ACD/LogD (pH 5.5): 2.75
ACD/BCF (pH 5.5): 40.50
ACD/KOC (pH 5.5): 249.26
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.30
Polar Surface Area: 76 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 50.8±3.0 dyne/cm
Molar Volume: 337.7±3.0 cm3

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