ChemSpider 2D Image | 5-(3,4-Diethoxyphenyl)-1-(2-fluorophenyl)-4-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one | C26H23F2NO4

5-(3,4-Diethoxyphenyl)-1-(2-fluorophenyl)-4-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC26H23F2NO4
  • Average mass451.462 Da
  • Monoisotopic mass451.159515 Da
  • ChemSpider ID59908160

More details:

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

2H-Pyrrol-2-one, 5-(3,4-diethoxyphenyl)-1-(2-fluorophenyl)-4-(4-fluorophenyl)-1,5-dihydro-3-hydroxy- [ACD/Index Name]
5-(3,4-Diethoxyphenyl)-1-(2-fluorophenyl)-4-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-(3,4-Diéthoxyphényl)-1-(2-fluorophényl)-4-(4-fluorophényl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
5-(3,4-Diethoxyphenyl)-1-(2-fluorphenyl)-4-(4-fluorphenyl)-3-hydroxy-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: 1.3±0.1 g/cm3
Boiling Point: 553.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.8±3.0 kJ/mol
Flash Point: 288.5±30.1 °C
Index of Refraction: 1.609
Molar Refractivity: 119.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.70
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 761.57
ACD/KOC (pH 5.5): 4020.53
ACD/LogD (pH 7.4): 4.08
ACD/BCF (pH 7.4): 740.90
ACD/KOC (pH 7.4): 3911.44
Polar Surface Area: 59 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 344.5±3.0 cm3

Click to predict properties on the Chemicalize site


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