ChemSpider 2D Image | 2-{[(1-Ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)sulfonyl]oxy}-1H-isoindole-1,3(2H)-dione | C21H14N2O6S

2-{[(1-Ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)sulfonyl]oxy}-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC21H14N2O6S
  • Average mass422.411 Da
  • Monoisotopic mass422.057251 Da
  • ChemSpider ID25986598

More details:

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

1H-Isoindole-1,3(2H)-dione, 2-[[(1-ethyl-1,2-dihydro-2-oxobenz[cd]indol-6-yl)sulfonyl]oxy]- [ACD/Index Name]
2-{[(1-Ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)sulfonyl]oxy}-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]
2-{[(1-Ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)sulfonyl]oxy}-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]
2-{[(1-Éthyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)sulfonyl]oxy}-1H-isoindole-1,3(2H)-dione [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 682.3±61.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.1±3.0 kJ/mol
Flash Point: 366.4±33.2 °C
Index of Refraction: 1.776
Molar Refractivity: 106.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.16
ACD/LogD (pH 5.5): 2.05
ACD/BCF (pH 5.5): 21.10
ACD/KOC (pH 5.5): 308.74
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 21.10
ACD/KOC (pH 7.4): 308.74
Polar Surface Area: 109 Å2
Polarizability: 42.3±0.5 10-24cm3
Surface Tension: 90.1±5.0 dyne/cm
Molar Volume: 255.3±5.0 cm3

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