ChemSpider 2D Image | Ethyl 3-(dodecylsulfanyl)-1H-indole-2-carboxylate | C23H35NO2S

Ethyl 3-(dodecylsulfanyl)-1H-indole-2-carboxylate

  • Molecular FormulaC23H35NO2S
  • Average mass389.595 Da
  • Monoisotopic mass389.238861 Da
  • ChemSpider ID28592177

More details:

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

1H-Indole-2-carboxylic acid, 3-(dodecylthio)-, ethyl ester [ACD/Index Name]
3-(Dodécylsulfanyl)-1H-indole-2-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-(dodecylsulfanyl)-1H-indole-2-carboxylate [ACD/IUPAC Name]
Ethyl-3-(dodecylsulfanyl)-1H-indol-2-carboxylat [German] [ACD/IUPAC Name]
872593-22-1 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 530.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.5±3.0 kJ/mol
Flash Point: 274.4±25.9 °C
Index of Refraction: 1.557
Molar Refractivity: 117.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 9.61
ACD/LogD (pH 5.5): 9.26
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2584323.25
ACD/LogD (pH 7.4): 9.26
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2584323.25
Polar Surface Area: 67 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 45.4±5.0 dyne/cm
Molar Volume: 364.9±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement