ChemSpider 2D Image | 3-Hydroxy-1-[2-(4-methoxyphenoxy)ethyl]-4-(2-naphthoyl)-5-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)-1,5-dihydro-2H-pyrrol-2-one | C32H26N2O9

3-Hydroxy-1-[2-(4-methoxyphenoxy)ethyl]-4-(2-naphthoyl)-5-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC32H26N2O9
  • Average mass582.557 Da
  • Monoisotopic mass582.163818 Da
  • ChemSpider ID117927510

More details:

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

2H-Pyrrol-2-one, 5-(2,3-dihydro-7-nitro-1,4-benzodioxin-6-yl)-1,5-dihydro-3-hydroxy-1-[2-(4-methoxyphenoxy)ethyl]-4-(2-naphthalenylcarbonyl)- [ACD/Index Name]
3-Hydroxy-1-[2-(4-methoxyphenoxy)ethyl]-4-(2-naphthoyl)-5-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
3-Hydroxy-1-[2-(4-methoxyphenoxy)ethyl]-4-(2-naphthoyl)-5-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
3-Hydroxy-1-[2-(4-méthoxyphénoxy)éthyl]-4-(2-naphtoyl)-5-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)-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: 1.4±0.1 g/cm3
Boiling Point: 804.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 122.6±3.0 kJ/mol
Flash Point: 440.3±34.3 °C
Index of Refraction: 1.682
Molar Refractivity: 154.8±0.3 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 5.74
ACD/LogD (pH 5.5): 3.33
ACD/BCF (pH 5.5): 112.68
ACD/KOC (pH 5.5): 518.50
ACD/LogD (pH 7.4): 1.57
ACD/BCF (pH 7.4): 1.94
ACD/KOC (pH 7.4): 8.94
Polar Surface Area: 140 Å2
Polarizability: 61.4±0.5 10-24cm3
Surface Tension: 65.6±3.0 dyne/cm
Molar Volume: 408.6±3.0 cm3

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