ChemSpider 2D Image | 1-(4-Acetylphenyl)-4-[4-(benzyloxy)phenyl]-5-(4-butoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one | C35H33NO5

1-(4-Acetylphenyl)-4-[4-(benzyloxy)phenyl]-5-(4-butoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC35H33NO5
  • Average mass547.640 Da
  • Monoisotopic mass547.235901 Da
  • ChemSpider ID59943213

More details:

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

1-(4-Acetylphenyl)-4-[4-(benzyloxy)phenyl]-5-(4-butoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
1-(4-Acetylphenyl)-4-[4-(benzyloxy)phenyl]-5-(4-butoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
1-(4-Acétylphényl)-4-[4-(benzyloxy)phényl]-5-(4-butoxyphényl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
2H-Pyrrol-2-one, 1-(4-acetylphenyl)-5-(4-butoxyphenyl)-1,5-dihydro-3-hydroxy-4-[4-(phenylmethoxy)phenyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 717.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 110.1±3.0 kJ/mol
Flash Point: 387.8±32.9 °C
Index of Refraction: 1.631
Molar Refractivity: 158.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.40
ACD/LogD (pH 5.5): 5.66
ACD/BCF (pH 5.5): 11876.02
ACD/KOC (pH 5.5): 28722.45
ACD/LogD (pH 7.4): 5.66
ACD/BCF (pH 7.4): 11753.59
ACD/KOC (pH 7.4): 28426.35
Polar Surface Area: 76 Å2
Polarizability: 62.8±0.5 10-24cm3
Surface Tension: 53.6±3.0 dyne/cm
Molar Volume: 444.9±3.0 cm3

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