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

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

  • Molecular FormulaC34H40N2O5
  • Average mass556.692 Da
  • Monoisotopic mass556.293701 Da
  • ChemSpider ID12054548

More details:

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

2H-Pyrrol-2-one, 4-(4-butoxybenzoyl)-1-[2-(diethylamino)ethyl]-1,5-dihydro-3-hydroxy-5-[4-(phenylmethoxy)phenyl]- [ACD/Index Name]
5-[4-(Benzyloxy)phenyl]-4-(4-butoxybenzoyl)-1-[2-(diethylamino)ethyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
5-[4-(Benzyloxy)phenyl]-4-(4-butoxybenzoyl)-1-[2-(diethylamino)ethyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-[4-(Benzyloxy)phényl]-4-(4-butoxybenzoyl)-1-[2-(diéthylamino)éthyl]-3-hydroxy-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: 723.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.9±3.0 kJ/mol
Flash Point: 391.1±32.9 °C
Index of Refraction: 1.595
Molar Refractivity: 160.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 7.35
ACD/LogD (pH 5.5): 2.83
ACD/BCF (pH 5.5): 20.42
ACD/KOC (pH 5.5): 57.59
ACD/LogD (pH 7.4): 2.85
ACD/BCF (pH 7.4): 21.82
ACD/KOC (pH 7.4): 61.53
Polar Surface Area: 79 Å2
Polarizability: 63.7±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 472.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement