ChemSpider 2D Image | N~2~-(2-~2~H_1_)Ethanoyl-L-asparagine | C6H9DN2O4

N2-(2-2H1)Ethanoyl-L-asparagine

  • Molecular FormulaC6H9DN2O4
  • Average mass175.161 Da
  • Monoisotopic mass175.070328 Da
  • ChemSpider ID68894863

  • 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-(1-oxoethyl-2-d)- [ACD/Index Name]
N2-(2-2H1)Ethanoyl-L-asparagin [German] [ACD/IUPAC Name]
N2-(2-2H1)Ethanoyl-L-asparagine [ACD/IUPAC Name]
N2-(2-2H1)Éthanoyl-L-asparagine [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: 588.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 96.0±6.0 kJ/mol
Flash Point: 309.8±28.7 °C
Index of Refraction: 1.508
Molar Refractivity: 38.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.84
ACD/LogD (pH 5.5): -3.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 58.2±3.0 dyne/cm
Molar Volume: 129.3±3.0 cm3

Click to predict properties on the Chemicalize site


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