ChemSpider 2D Image | Methyl (2E)-3-[2-methyl-1-(phenylsulfonyl)-1H-indol-3-yl]-2-butenoate | C20H19NO4S

Methyl (2E)-3-[2-methyl-1-(phenylsulfonyl)-1H-indol-3-yl]-2-butenoate

  • Molecular FormulaC20H19NO4S
  • Average mass369.434 Da
  • Monoisotopic mass369.103485 Da
  • ChemSpider ID24741651

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-[2-Méthyl-1-(phénylsulfonyl)-1H-indol-3-yl]-2-buténoate de méthyle [French] [ACD/IUPAC Name]
2-Butenoic acid, 3-[2-methyl-1-(phenylsulfonyl)-1H-indol-3-yl]-, methyl ester, (2E)- [ACD/Index Name]
Methyl (2E)-3-[2-methyl-1-(phenylsulfonyl)-1H-indol-3-yl]-2-butenoate [ACD/IUPAC Name]
Methyl-(2E)-3-[2-methyl-1-(phenylsulfonyl)-1H-indol-3-yl]-2-butenoat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 553.6±58.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.4±3.0 kJ/mol
Flash Point: 288.6±32.3 °C
Index of Refraction: 1.596
Molar Refractivity: 102.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.68
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 456.86
ACD/KOC (pH 5.5): 2789.17
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 456.86
ACD/KOC (pH 7.4): 2789.17
Polar Surface Area: 74 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 44.9±7.0 dyne/cm
Molar Volume: 301.2±7.0 cm3

Click to predict properties on the Chemicalize site


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