ChemSpider 2D Image | N-(1-Deoxy-D-fructos-1-yl)-L-asparagine | C10H18N2O8

N-(1-Deoxy-D-fructos-1-yl)-L-asparagine

  • Molecular FormulaC10H18N2O8
  • Average mass294.259 Da
  • Monoisotopic mass294.106323 Da
  • ChemSpider ID31046438

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2S)-4-Amino-4-oxo-2-{[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino}butanoic acid [ACD/IUPAC Name]
(2S)-4-Amino-4-oxo-2-{[(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl]amino}butansäure [German] [ACD/IUPAC Name]
34393-27-6 [RN]
Acide (2S)-4-amino-4-oxo-2-{[(3S,4R,5R)-3,4,5,6-tétrahydroxy-2-oxohexyl]amino}butanoïque [French] [ACD/IUPAC Name]
D-Fructose, 1-[[(1S)-3-amino-1-carboxy-3-oxopropyl]amino]-1-deoxy- [ACD/Index Name]
N-(1-Deoxy-D-fructos-1-yl)-L-asparagine
Fructose-asparagine

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

Density: 1.6±0.1 g/cm3
Boiling Point: 805.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.5 mmHg at 25°C
Enthalpy of Vaporization: 133.4±6.0 kJ/mol
Flash Point: 441.0±34.3 °C
Index of Refraction: 1.592
Molar Refractivity: 63.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 8
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: -1.24
ACD/LogD (pH 5.5): -3.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 190 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 90.6±3.0 dyne/cm
Molar Volume: 186.5±3.0 cm3

Click to predict properties on the Chemicalize site


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