ChemSpider 2D Image | 2-Hydroxy-3-[(2,4,5,6,7-~2~H_5_)-1H-indol-3-yl]propanoic acid | C11H6D5NO3

2-Hydroxy-3-[(2,4,5,6,7-2H5)-1H-indol-3-yl]propanoic acid

  • Molecular FormulaC11H6D5NO3
  • Average mass210.241 Da
  • Monoisotopic mass210.105270 Da
  • ChemSpider ID77494419

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Indole-2,4,5,6,7-d5-3-propanoic acid, α-hydroxy- [ACD/Index Name]
2-Hydroxy-3-[(2,4,5,6,7-2H5)-1H-indol-3-yl]propanoic acid [ACD/IUPAC Name]
2-Hydroxy-3-[(2,4,5,6,7-2H5)-1H-indol-3-yl]propansäure [German] [ACD/IUPAC Name]
Acide 2-hydroxy-3-[(2,4,5,6,7-2H5)-1H-indol-3-yl]propanoïque [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 477.3±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±3.0 kJ/mol
Flash Point: 242.4±24.6 °C
Index of Refraction: 1.704
Molar Refractivity: 55.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.97
ACD/LogD (pH 5.5): -0.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 75.1±3.0 dyne/cm
Molar Volume: 143.7±3.0 cm3

Click to predict properties on the Chemicalize site


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