ChemSpider 2D Image | {2-Methyl-5-[(~2~H_3_)methyloxy]-1H-indol-3-yl}acetic acid | C12H10D3NO3

{2-Methyl-5-[(2H3)methyloxy]-1H-indol-3-yl}acetic acid

  • Molecular FormulaC12H10D3NO3
  • Average mass222.255 Da
  • Monoisotopic mass222.108368 Da
  • ChemSpider ID58778678

  • Non-standard isotope - Non-standard isotope

More details:

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

{2-Methyl-5-[(2H3)methyloxy]-1H-indol-3-yl}acetic acid [ACD/IUPAC Name]
{2-Methyl-5-[(2H3)methyloxy]-1H-indol-3-yl}essigsäure [German] [ACD/IUPAC Name]
1H-Indole-3-acetic acid, 2-methyl-5-(methyl-d3-oxy)- [ACD/Index Name]
Acide {2-méthyl-5-[(2H3)méthyloxy]-1H-indol-3-yl}acétique [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 450.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.7±3.0 kJ/mol
Flash Point: 226.1±27.3 °C
Index of Refraction: 1.641
Molar Refractivity: 61.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.80
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 2.08
ACD/KOC (pH 5.5): 25.12
ACD/LogD (pH 7.4): -0.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 62 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 169.6±3.0 cm3

Click to predict properties on the Chemicalize site


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