ChemSpider 2D Image | 5-[4-(Benzyloxy)-3-methoxyphenyl]-4-{[4-(benzyloxy)phenyl](hydroxy)methylene}-1-[2-(diethylamino)ethyl]-2,3-pyrrolidinedione | C38H40N2O6

5-[4-(Benzyloxy)-3-methoxyphenyl]-4-{[4-(benzyloxy)phenyl](hydroxy)methylene}-1-[2-(diethylamino)ethyl]-2,3-pyrrolidinedione

  • Molecular FormulaC38H40N2O6
  • Average mass620.734 Da
  • Monoisotopic mass620.288635 Da
  • ChemSpider ID3666914

More details:






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

2,3-Pyrrolidinedione, 1-[2-(diethylamino)ethyl]-4-[hydroxy[4-(phenylmethoxy)phenyl]methylene]-5-[3-methoxy-4-(phenylmethoxy)phenyl]- [ACD/Index Name]
5-[4-(Benzyloxy)-3-methoxyphenyl]-4-{[4-(benzyloxy)phenyl](hydroxy)methylen}-1-[2-(diethylamino)ethyl]-2,3-pyrrolidindion [German] [ACD/IUPAC Name]
5-[4-(Benzyloxy)-3-methoxyphenyl]-4-{[4-(benzyloxy)phenyl](hydroxy)methylene}-1-[2-(diethylamino)ethyl]-2,3-pyrrolidinedione [ACD/IUPAC Name]
5-[4-(Benzyloxy)-3-méthoxyphényl]-4-{[4-(benzyloxy)phényl](hydroxy)méthylène}-1-[2-(diéthylamino)éthyl]-2,3-pyrrolidinedione [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 764.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.8±3.0 kJ/mol
Flash Point: 416.2±35.7 °C
Index of Refraction: 1.616
Molar Refractivity: 178.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 7.36
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 8.55
ACD/KOC (pH 5.5): 22.18
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 83.43
ACD/KOC (pH 7.4): 216.32
Polar Surface Area: 89 Å2
Polarizability: 70.6±0.5 10-24cm3
Surface Tension: 52.2±3.0 dyne/cm
Molar Volume: 509.9±3.0 cm3

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