ChemSpider 2D Image | N~2~-{[2-(2-Amino-2-oxoethoxy)ethyl]carbamoyl}-D-asparagine | C9H16N4O6

N2-{[2-(2-Amino-2-oxoethoxy)ethyl]carbamoyl}-D-asparagine

  • Molecular FormulaC9H16N4O6
  • Average mass276.246 Da
  • Monoisotopic mass276.106995 Da
  • ChemSpider ID55003989

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Asparagine, N2-[[[2-(2-amino-2-oxoethoxy)ethyl]amino]carbonyl]- [ACD/Index Name]
N2-{[2-(2-Amino-2-oxoethoxy)ethyl]carbamoyl}-D-asparagin [German] [ACD/IUPAC Name]
N2-{[2-(2-Amino-2-oxoethoxy)ethyl]carbamoyl}-D-asparagine [ACD/IUPAC Name]
N2-{[2-(2-Amino-2-oxoéthoxy)éthyl]carbamoyl}-D-asparagine [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 768.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 121.7±6.0 kJ/mol
Flash Point: 418.7±32.9 °C
Index of Refraction: 1.543
Molar Refractivity: 61.4±0.3 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: -2.96
ACD/LogD (pH 5.5): -4.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 174 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 67.4±3.0 dyne/cm
Molar Volume: 194.8±3.0 cm3

Click to predict properties on the Chemicalize site


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