ChemSpider 2D Image | 1-(3,4-Dichlorophenyl)-5-(2-fluorophenyl)-3-hydroxy-4-(4-isobutoxy-3-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one | C28H24Cl2FNO4

1-(3,4-Dichlorophenyl)-5-(2-fluorophenyl)-3-hydroxy-4-(4-isobutoxy-3-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC28H24Cl2FNO4
  • Average mass528.399 Da
  • Monoisotopic mass527.106628 Da
  • ChemSpider ID34937830

More details:

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

1-(3,4-Dichlorophenyl)-5-(2-fluorophenyl)-3-hydroxy-4-(4-isobutoxy-3-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
1-(3,4-Dichlorophényl)-5-(2-fluorophényl)-3-hydroxy-4-(4-isobutoxy-3-méthylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
1-(3,4-Dichlorphenyl)-5-(2-fluorphenyl)-3-hydroxy-4-(4-isobutoxy-3-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
2H-Pyrrol-2-one, 1-(3,4-dichlorophenyl)-5-(2-fluorophenyl)-1,5-dihydro-3-hydroxy-4-[3-methyl-4-(2-methylpropoxy)benzoyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 644.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.9±3.0 kJ/mol
Flash Point: 343.5±31.5 °C
Index of Refraction: 1.628
Molar Refractivity: 137.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.47
ACD/LogD (pH 5.5): 5.01
ACD/BCF (pH 5.5): 2117.49
ACD/KOC (pH 5.5): 4232.87
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 36.53
ACD/KOC (pH 7.4): 73.02
Polar Surface Area: 67 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 54.8±3.0 dyne/cm
Molar Volume: 386.2±3.0 cm3

Click to predict properties on the Chemicalize site


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