ChemSpider 2D Image | 5-[(~2~H_3_)Methyloxy]-1H-indole-3-carboxylic acid | C10H6D3NO3

5-[(2H3)Methyloxy]-1H-indole-3-carboxylic acid

  • Molecular FormulaC10H6D3NO3
  • Average mass194.202 Da
  • Monoisotopic mass194.077072 Da
  • ChemSpider ID114810746

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Indole-3-carboxylic acid, 5-(methyl-d3-oxy)- [ACD/Index Name]
5-[(2H3)Methyloxy]-1H-indol-3-carbonsäure [German] [ACD/IUPAC Name]
5-[(2H3)Methyloxy]-1H-indole-3-carboxylic acid [ACD/IUPAC Name]
Acide 5-[(2H3)méthyloxy]-1H-indole-3-carboxylique [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: 447.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 224.5±23.2 °C
Index of Refraction: 1.677
Molar Refractivity: 52.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.90
ACD/LogD (pH 5.5): 0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.37
ACD/LogD (pH 7.4): -0.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 62 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 62.7±3.0 dyne/cm
Molar Volume: 138.4±3.0 cm3

Click to predict properties on the Chemicalize site


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