ChemSpider 2D Image | 5-(4-Ethylphenyl)-1-(4-fluorobenzyl)-3-hydroxy-4-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one | C26H24FNO3

5-(4-Ethylphenyl)-1-(4-fluorobenzyl)-3-hydroxy-4-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC26H24FNO3
  • Average mass417.472 Da
  • Monoisotopic mass417.174011 Da
  • ChemSpider ID29036723

More details:

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

2H-Pyrrol-2-one, 5-(4-ethylphenyl)-1-[(4-fluorophenyl)methyl]-1,5-dihydro-3-hydroxy-4-(4-methoxyphenyl)- [ACD/Index Name]
5-(4-Ethylphenyl)-1-(4-fluorbenzyl)-3-hydroxy-4-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
5-(4-Ethylphenyl)-1-(4-fluorobenzyl)-3-hydroxy-4-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-(4-Éthylphényl)-1-(4-fluorobenzyl)-3-hydroxy-4-(4-méthoxyphényl)-1,5-dihydro-2H-pyrrol-2-one [French] [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: 623.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.1±3.0 kJ/mol
Flash Point: 330.9±31.5 °C
Index of Refraction: 1.631
Molar Refractivity: 117.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.07
ACD/LogD (pH 5.5): 4.74
ACD/BCF (pH 5.5): 2359.57
ACD/KOC (pH 5.5): 9033.67
ACD/LogD (pH 7.4): 4.74
ACD/BCF (pH 7.4): 2351.53
ACD/KOC (pH 7.4): 9002.89
Polar Surface Area: 50 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 330.2±3.0 cm3

Click to predict properties on the Chemicalize site


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