ChemSpider 2D Image | 1-(3,5-Dichlorophenyl)-5-(4-fluorophenyl)-3-hydroxy-4-[2-methoxy-5-(2-methyl-2-propanyl)benzoyl]-1,5-dihydro-2H-pyrrol-2-one | C28H24Cl2FNO4

1-(3,5-Dichlorophenyl)-5-(4-fluorophenyl)-3-hydroxy-4-[2-methoxy-5-(2-methyl-2-propanyl)benzoyl]-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC28H24Cl2FNO4
  • Average mass528.399 Da
  • Monoisotopic mass527.106628 Da
  • ChemSpider ID34936556

More details:

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

1-(3,5-Dichlorophenyl)-5-(4-fluorophenyl)-3-hydroxy-4-[2-methoxy-5-(2-methyl-2-propanyl)benzoyl]-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
1-(3,5-Dichlorophényl)-5-(4-fluorophényl)-3-hydroxy-4-[2-méthoxy-5-(2-méthyl-2-propanyl)benzoyl]-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
1-(3,5-Dichlorphenyl)-5-(4-fluorphenyl)-3-hydroxy-4-[2-methoxy-5-(2-methyl-2-propanyl)benzoyl]-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
2H-Pyrrol-2-one, 1-(3,5-dichlorophenyl)-4-[5-(1,1-dimethylethyl)-2-methoxybenzoyl]-5-(4-fluorophenyl)-1,5-dihydro-3-hydroxy- [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: 651.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.9±3.0 kJ/mol
Flash Point: 347.9±31.5 °C
Index of Refraction: 1.625
Molar Refractivity: 136.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 6.99
ACD/LogD (pH 5.5): 5.09
ACD/BCF (pH 5.5): 2458.63
ACD/KOC (pH 5.5): 4710.53
ACD/LogD (pH 7.4): 3.33
ACD/BCF (pH 7.4): 42.41
ACD/KOC (pH 7.4): 81.26
Polar Surface Area: 67 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 386.7±3.0 cm3

Click to predict properties on the Chemicalize site


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