ChemSpider 2D Image | 2-[({6-[(4-Methoxyphenyl)sulfonyl]-3-pyridinyl}carbonyl)oxy]-1H-isoindole-1,3(2H)-dione | C21H14N2O7S

2-[({6-[(4-Methoxyphenyl)sulfonyl]-3-pyridinyl}carbonyl)oxy]-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC21H14N2O7S
  • Average mass438.410 Da
  • Monoisotopic mass438.052185 Da
  • ChemSpider ID71096628

More details:

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

1H-Isoindole-1,3(2H)-dione, 2-[[[6-[(4-methoxyphenyl)sulfonyl]-3-pyridinyl]carbonyl]oxy]- [ACD/Index Name]
2-[({6-[(4-Methoxyphenyl)sulfonyl]-3-pyridinyl}carbonyl)oxy]-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]
2-[({6-[(4-Methoxyphenyl)sulfonyl]-3-pyridinyl}carbonyl)oxy]-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]
2-[({6-[(4-Méthoxyphényl)sulfonyl]-3-pyridinyl}carbonyl)oxy]-1H-isoindole-1,3(2H)-dione [French] [ACD/IUPAC Name]
1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 6-(4-methoxybenzenesulfonyl)pyridine-3-carboxylate
2248306-37-6 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 675.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 362.4±34.3 °C
Index of Refraction: 1.701
Molar Refractivity: 107.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.56
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 42.71
ACD/KOC (pH 5.5): 511.36
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 42.71
ACD/KOC (pH 7.4): 511.36
Polar Surface Area: 128 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 83.1±5.0 dyne/cm
Molar Volume: 276.4±5.0 cm3

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