ChemSpider 2D Image | 5-(3,4-Dichlorophenyl)-1-(3,4-difluorophenyl)-3-hydroxy-4-(4-nitrobenzoyl)-1,5-dihydro-2H-pyrrol-2-one | C23H12Cl2F2N2O5

5-(3,4-Dichlorophenyl)-1-(3,4-difluorophenyl)-3-hydroxy-4-(4-nitrobenzoyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC23H12Cl2F2N2O5
  • Average mass505.255 Da
  • Monoisotopic mass504.009125 Da
  • ChemSpider ID60040688

More details:

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

2H-Pyrrol-2-one, 5-(3,4-dichlorophenyl)-1-(3,4-difluorophenyl)-1,5-dihydro-3-hydroxy-4-(4-nitrobenzoyl)- [ACD/Index Name]
5-(3,4-Dichlorophenyl)-1-(3,4-difluorophenyl)-3-hydroxy-4-(4-nitrobenzoyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-(3,4-Dichlorophényl)-1-(3,4-difluorophényl)-3-hydroxy-4-(4-nitrobenzoyl)-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
5-(3,4-Dichlorphenyl)-1-(3,4-difluorphenyl)-3-hydroxy-4-(4-nitrobenzoyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 654.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 349.3±31.5 °C
Index of Refraction: 1.682
Molar Refractivity: 118.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.36
ACD/LogD (pH 5.5): 3.22
ACD/BCF (pH 5.5): 93.38
ACD/KOC (pH 5.5): 453.26
ACD/LogD (pH 7.4): 1.46
ACD/BCF (pH 7.4): 1.61
ACD/KOC (pH 7.4): 7.82
Polar Surface Area: 103 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 69.2±3.0 dyne/cm
Molar Volume: 312.1±3.0 cm3

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