ChemSpider 2D Image | N~2~-(2-Aminoethyl)-alpha-asparagine | C6H13N3O3

N2-(2-Aminoethyl)-α-asparagine

  • Molecular FormulaC6H13N3O3
  • Average mass175.186 Da
  • Monoisotopic mass175.095688 Da
  • ChemSpider ID25994589

More details:

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

N2-(2-Aminoethyl)-α-asparagin [German] [ACD/IUPAC Name]
N2-(2-Aminoethyl)-α-asparagine [ACD/IUPAC Name]
N2-(2-Aminoéthyl)-α-asparagine [French] [ACD/IUPAC Name]
3-[(2-aminoethyl)amino]-3-carbamoylpropanoic acid
785730-69-0 [RN]
MFCD16990634 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 457.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 78.6±6.0 kJ/mol
Flash Point: 230.2±28.7 °C
Index of Refraction: 1.531
Molar Refractivity: 42.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -1.69
ACD/LogD (pH 5.5): -4.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 118 Å2
Polarizability: 16.7±0.5 10-24cm3
Surface Tension: 61.9±3.0 dyne/cm
Molar Volume: 135.9±3.0 cm3

Click to predict properties on the Chemicalize site


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