ChemSpider 2D Image | (2E)-3-(1H-Indol-2-yl)acrylic acid | C11H9NO2

(2E)-3-(1H-Indol-2-yl)acrylic acid

  • Molecular FormulaC11H9NO2
  • Average mass187.195 Da
  • Monoisotopic mass187.063324 Da
  • ChemSpider ID62979531

More details:






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

(2E)-3-(1H-Indol-2-yl)acrylic acid [ACD/IUPAC Name]
(2E)-3-(1H-Indol-2-yl)acrylsäure [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-(1H-indol-2-yl)-, (2E)- [ACD/Index Name]
Acide (2E)-3-(1H-indol-2-yl)acrylique [French] [ACD/IUPAC Name]
606493-58-7 [RN]
Indoleacrylic acid

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 432.8±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.6±3.0 kJ/mol
Flash Point: 215.6±21.8 °C
Index of Refraction: 1.750
Molar Refractivity: 56.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 1.81
ACD/BCF (pH 5.5): 10.19
ACD/KOC (pH 5.5): 125.97
ACD/LogD (pH 7.4): 0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.23
Polar Surface Area: 53 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 68.5±3.0 dyne/cm
Molar Volume: 137.5±3.0 cm3

Click to predict properties on the Chemicalize site






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