ChemSpider 2D Image | N~2~-(~2~H_1_)Methyl-L-asparagine | C5H9DN2O3

N2-(2H1)Methyl-L-asparagine

  • Molecular FormulaC5H9DN2O3
  • Average mass147.151 Da
  • Monoisotopic mass147.075424 Da
  • ChemSpider ID67494255
  • 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

L-Asparagine, N2-methyl-d- [ACD/Index Name]
N2-(2H1)Methyl-L-asparagin [German] [ACD/IUPAC Name]
N2-(2H1)Methyl-L-asparagine [ACD/IUPAC Name]
N2-(2H1)Méthyl-L-asparagine [French] [ACD/IUPAC Name]
N-methyl-d-asparaginic acid

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

Density: 1.3±0.1 g/cm3
Boiling Point: 400.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 71.5±6.0 kJ/mol
Flash Point: 196.1±27.3 °C
Index of Refraction: 1.498
Molar Refractivity: 33.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.27
ACD/LogD (pH 5.5): -3.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 13.4±0.5 10-24cm3
Surface Tension: 53.1±3.0 dyne/cm
Molar Volume: 115.7±3.0 cm3

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