ChemSpider 2D Image | 4-[(E)-2-(2,4-Dinitrophenyl)vinyl]-2-methoxyphenyl 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate | C26H19N3O9

4-[(E)-2-(2,4-Dinitrophenyl)vinyl]-2-methoxyphenyl 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate

  • Molecular FormulaC26H19N3O9
  • Average mass517.444 Da
  • Monoisotopic mass517.112122 Da
  • ChemSpider ID12107271

  • Double-bond stereo - Double-bond stereo

More details:

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

2H-Isoindole-2-propanoic acid, 1,3-dihydro-1,3-dioxo-, 4-[(E)-2-(2,4-dinitrophenyl)ethenyl]-2-methoxyphenyl ester [ACD/Index Name]
3-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate de 4-[(E)-2-(2,4-dinitrophényl)vinyl]-2-méthoxyphényle [French] [ACD/IUPAC Name]
4-[(E)-2-(2,4-Dinitrophenyl)vinyl]-2-methoxyphenyl 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate [ACD/IUPAC Name]
4-[(E)-2-(2,4-Dinitrophenyl)vinyl]-2-methoxyphenyl-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 670.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.5±3.0 kJ/mol
Flash Point: 359.1±31.5 °C
Index of Refraction: 1.691
Molar Refractivity: 135.0±0.3 cm3
#H bond acceptors: 12
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 5.07
ACD/LogD (pH 5.5): 4.50
ACD/BCF (pH 5.5): 1541.21
ACD/KOC (pH 5.5): 6659.93
ACD/LogD (pH 7.4): 4.50
ACD/BCF (pH 7.4): 1541.21
ACD/KOC (pH 7.4): 6659.93
Polar Surface Area: 165 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 70.0±3.0 dyne/cm
Molar Volume: 353.1±3.0 cm3

Click to predict properties on the Chemicalize site


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