ChemSpider 2D Image | N-(~2~H_1_)Methyl-L-aspartic acid | C5H8DNO4

N-(2H1)Methyl-L-aspartic acid

  • Molecular FormulaC5H8DNO4
  • Average mass148.135 Da
  • Monoisotopic mass148.059433 Da
  • ChemSpider ID65793132

  • 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

Acide N-(2H1)méthyl-L-aspartique [French] [ACD/IUPAC Name]
L-Aspartic acid, N-methyl-d- [ACD/Index Name]
N-(2H1)Methyl-L-asparaginsäure [German] [ACD/IUPAC Name]
N-(2H1)Methyl-L-aspartic acid [ACD/IUPAC Name]
N-Methyl-D-aspartic acid [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: 258.2±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 54.6±6.0 kJ/mol
Flash Point: 110.0±24.6 °C
Index of Refraction: 1.494
Molar Refractivity: 31.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.44
ACD/LogD (pH 5.5): -3.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 56.3±3.0 dyne/cm
Molar Volume: 109.5±3.0 cm3

Click to predict properties on the Chemicalize site


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