ChemSpider 2D Image | MFCD03301076 | C33H38N2O6

MFCD03301076

  • Molecular FormulaC33H38N2O6
  • Average mass558.665 Da
  • Monoisotopic mass558.273010 Da
  • ChemSpider ID11888502

More details:

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

2H-Pyrrol-2-one, 1-[2-(diethylamino)ethyl]-5-(3,4-dimethoxyphenyl)-1,5-dihydro-3-hydroxy-4-[3-methyl-4-(phenylmethoxy)benzoyl]- [ACD/Index Name]
4-[4-(Benzyloxy)-3-methylbenzoyl]-1-[2-(diethylamino)ethyl]-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
4-[4-(Benzyloxy)-3-methylbenzoyl]-1-[2-(diethylamino)ethyl]-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
4-[4-(Benzyloxy)-3-méthylbenzoyl]-1-[2-(diéthylamino)éthyl]-5-(3,4-diméthoxyphényl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
MFCD03301076
1-[2-(diethylamino)ethyl]-5-(3,4-dimethoxyphenyl)-3-hydroxy-4-{[3-methyl-4-(phenylmethoxy)phenyl]carbonyl}-3-pyrrolin-2-one
4-(4-(benzyloxy)-3-methylbenzoyl)-1-(2-(diethylamino)ethyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1H-pyrrol-2(5H)-one
4-[4-(benzyloxy)-3-methylbenzoyl]-1-[2-(diethylamino)ethyl]-5-(3,4-dimethoxyphenyl)-3-hydroxy-2,5-dihydro-1H-pyrrol-2-one
4-{[4-(benzyloxy)-3-methylphenyl]carbonyl}-1-[2-(diethylamino)ethyl]-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one

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

Density: 1.2±0.1 g/cm3
Boiling Point: 725.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.2±3.0 kJ/mol
Flash Point: 392.7±32.9 °C
Index of Refraction: 1.599
Molar Refractivity: 158.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 6.03
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 7.22
ACD/KOC (pH 5.5): 27.35
ACD/LogD (pH 7.4): 2.26
ACD/BCF (pH 7.4): 7.71
ACD/KOC (pH 7.4): 29.22
Polar Surface Area: 89 Å2
Polarizability: 62.8±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 463.6±3.0 cm3

Click to predict properties on the Chemicalize site


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