ChemSpider 2D Image | 1-{1-[(4-Methylphenyl)sulfonyl]-1H-indol-3-yl}ethyl [(4-methylphenyl)sulfonyl]acetate | C26H25NO6S2

1-{1-[(4-Methylphenyl)sulfonyl]-1H-indol-3-yl}ethyl [(4-methylphenyl)sulfonyl]acetate

  • Molecular FormulaC26H25NO6S2
  • Average mass511.610 Da
  • Monoisotopic mass511.112335 Da
  • ChemSpider ID26587471

More details:

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

[(4-Méthylphényl)sulfonyl]acétate de 1-{1-[(4-méthylphényl)sulfonyl]-1H-indol-3-yl}éthyle [French] [ACD/IUPAC Name]
1-{1-[(4-Methylphenyl)sulfonyl]-1H-indol-3-yl}ethyl [(4-methylphenyl)sulfonyl]acetate [ACD/IUPAC Name]
1-{1-[(4-Methylphenyl)sulfonyl]-1H-indol-3-yl}ethyl-[(4-methylphenyl)sulfonyl]acetat [German] [ACD/IUPAC Name]
Acetic acid, 2-[(4-methylphenyl)sulfonyl]-, 1-[1-[(4-methylphenyl)sulfonyl]-1H-indol-3-yl]ethyl ester [ACD/Index 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: 718.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.9±3.0 kJ/mol
Flash Point: 388.2±35.7 °C
Index of Refraction: 1.624
Molar Refractivity: 137.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.57
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 848.00
ACD/KOC (pH 5.5): 4342.56
ACD/LogD (pH 7.4): 4.16
ACD/BCF (pH 7.4): 848.00
ACD/KOC (pH 7.4): 4342.56
Polar Surface Area: 116 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 50.6±7.0 dyne/cm
Molar Volume: 389.1±7.0 cm3

Click to predict properties on the Chemicalize site


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