ChemSpider 2D Image | 1-(3,4-Difluorophenyl)-4,5-bis(4-ethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one | C26H23F2NO4

1-(3,4-Difluorophenyl)-4,5-bis(4-ethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC26H23F2NO4
  • Average mass451.462 Da
  • Monoisotopic mass451.159515 Da
  • ChemSpider ID59962742

More details:

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

1-(3,4-Difluorophenyl)-4,5-bis(4-ethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
1-(3,4-Difluorophényl)-4,5-bis(4-éthoxyphényl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
1-(3,4-Difluorphenyl)-4,5-bis(4-ethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
2H-Pyrrol-2-one, 1-(3,4-difluorophenyl)-4,5-bis(4-ethoxyphenyl)-1,5-dihydro-3-hydroxy- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 590.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 311.0±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: 5.78
ACD/LogD (pH 5.5): 4.50
ACD/BCF (pH 5.5): 1544.12
ACD/KOC (pH 5.5): 6668.38
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1509.87
ACD/KOC (pH 7.4): 6520.47
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


Advertisement