ChemSpider 2D Image | 5-[4-(Benzyloxy)phenyl]-1-[2-(diethylamino)ethyl]-3-hydroxy-4-(4-isopropoxy-2-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one | C34H40N2O5

5-[4-(Benzyloxy)phenyl]-1-[2-(diethylamino)ethyl]-3-hydroxy-4-(4-isopropoxy-2-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC34H40N2O5
  • Average mass556.692 Da
  • Monoisotopic mass556.293701 Da
  • ChemSpider ID12054556

More details:

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

2H-Pyrrol-2-one, 1-[2-(diethylamino)ethyl]-1,5-dihydro-3-hydroxy-4-[2-methyl-4-(1-methylethoxy)benzoyl]-5-[4-(phenylmethoxy)phenyl]- [ACD/Index Name]
5-[4-(Benzyloxy)phenyl]-1-[2-(diethylamino)ethyl]-3-hydroxy-4-(4-isopropoxy-2-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
5-[4-(Benzyloxy)phenyl]-1-[2-(diethylamino)ethyl]-3-hydroxy-4-(4-isopropoxy-2-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-[4-(Benzyloxy)phényl]-1-[2-(diéthylamino)éthyl]-3-hydroxy-4-(4-isopropoxy-2-méthylbenzoyl)-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: 1.2±0.1 g/cm3
Boiling Point: 728.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.6±3.0 kJ/mol
Flash Point: 394.3±32.9 °C
Index of Refraction: 1.596
Molar Refractivity: 160.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 7.09
ACD/LogD (pH 5.5): 2.87
ACD/BCF (pH 5.5): 22.00
ACD/KOC (pH 5.5): 60.73
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 23.50
ACD/KOC (pH 7.4): 64.89
Polar Surface Area: 79 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 473.0±3.0 cm3

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