ChemSpider 2D Image | Ethyl 1-benzyl-5-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoyl]oxy}-2-methyl-1H-indole-3-carboxylate | C30H26N2O6

Ethyl 1-benzyl-5-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoyl]oxy}-2-methyl-1H-indole-3-carboxylate

  • Molecular FormulaC30H26N2O6
  • Average mass510.537 Da
  • Monoisotopic mass510.179077 Da
  • ChemSpider ID3567830

More details:

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

1-Benzyl-5-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoyl]oxy}-2-méthyl-1H-indole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1H-Indole-3-carboxylic acid, 5-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-1-oxopropoxy]-2-methyl-1-(phenylmethyl)-, ethyl ester [ACD/Index Name]
Ethyl 1-benzyl-5-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoyl]oxy}-2-methyl-1H-indole-3-carboxylate [ACD/IUPAC Name]
Ethyl-1-benzyl-5-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoyl]oxy}-2-methyl-1H-indol-3-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 690.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 371.5±31.5 °C
Index of Refraction: 1.639
Molar Refractivity: 141.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 6.38
ACD/LogD (pH 5.5): 5.57
ACD/BCF (pH 5.5): 10042.14
ACD/KOC (pH 5.5): 25473.99
ACD/LogD (pH 7.4): 5.57
ACD/BCF (pH 7.4): 10042.14
ACD/KOC (pH 7.4): 25473.99
Polar Surface Area: 95 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 49.9±7.0 dyne/cm
Molar Volume: 393.3±7.0 cm3

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