ChemSpider 2D Image | 1-(~2~H_3_)Methyl-L-tryptophan | C12H11D3N2O2

1-(2H3)Methyl-L-tryptophan

  • Molecular FormulaC12H11D3N2O2
  • Average mass221.270 Da
  • Monoisotopic mass221.124359 Da
  • ChemSpider ID24533649

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

1-(2H3)Methyl-L-tryptophan [ACD/IUPAC Name]
1-(2H3)Methyl-L-tryptophan [German] [ACD/IUPAC Name]
1-(2H3)Méthyl-L-tryptophane [French] [ACD/IUPAC Name]
L-Tryptophan, 1-methyl-d3- [ACD/Index Name]
(S)-Indoximod-d3
1801851-87-5 [RN]
1-Methyl-d3-L-tryptophan

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

Density: 1.3±0.1 g/cm3
Boiling Point: 429.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.2±3.0 kJ/mol
Flash Point: 213.4±25.9 °C
Index of Refraction: 1.625
Molar Refractivity: 60.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.43
ACD/LogD (pH 5.5): -0.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 68 Å2
Polarizability: 23.8±0.5 10-24cm3
Surface Tension: 50.5±7.0 dyne/cm
Molar Volume: 170.0±7.0 cm3

Click to predict properties on the Chemicalize site


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