ChemSpider 2D Image | Ethyl (2Z)-3-[2-(2-methoxy-2-oxoethyl)-1-(phenylsulfonyl)-1H-indol-3-yl]acrylate | C22H21NO6S

Ethyl (2Z)-3-[2-(2-methoxy-2-oxoethyl)-1-(phenylsulfonyl)-1H-indol-3-yl]acrylate

  • Molecular FormulaC22H21NO6S
  • Average mass427.470 Da
  • Monoisotopic mass427.108948 Da
  • ChemSpider ID30655096

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-3-[2-(2-Méthoxy-2-oxoéthyl)-1-(phénylsulfonyl)-1H-indol-3-yl]acrylate d'éthyle [French] [ACD/IUPAC Name]
1H-Indole-2-acetic acid, 3-[(1Z)-3-ethoxy-3-oxo-1-propen-1-yl]-1-(phenylsulfonyl)-, methyl ester [ACD/Index Name]
Ethyl (2Z)-3-[2-(2-methoxy-2-oxoethyl)-1-(phenylsulfonyl)-1H-indol-3-yl]acrylate [ACD/IUPAC Name]
Ethyl-(2Z)-3-[2-(2-methoxy-2-oxoethyl)-1-(phenylsulfonyl)-1H-indol-3-yl]acrylat [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: 610.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.7±3.0 kJ/mol
Flash Point: 323.2±34.3 °C
Index of Refraction: 1.591
Molar Refractivity: 114.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.95
ACD/LogD (pH 5.5): 3.54
ACD/BCF (pH 5.5): 289.19
ACD/KOC (pH 5.5): 2010.58
ACD/LogD (pH 7.4): 3.54
ACD/BCF (pH 7.4): 289.19
ACD/KOC (pH 7.4): 2010.58
Polar Surface Area: 100 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 48.0±7.0 dyne/cm
Molar Volume: 337.9±7.0 cm3

Click to predict properties on the Chemicalize site


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