ChemSpider 2D Image | N-[(3S)-3-(Aminomethyl)-5-methylhexanoyl]-beta-D-glucopyranosylamine | C14H28N2O6

N-[(3S)-3-(Aminomethyl)-5-methylhexanoyl]-β-D-glucopyranosylamine

  • Molecular FormulaC14H28N2O6
  • Average mass320.382 Da
  • Monoisotopic mass320.194733 Da
  • ChemSpider ID24679078

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

N-[(3S)-3-(Aminomethyl)-5-methylhexanoyl]-β-D-glucopyranosylamin [German] [ACD/IUPAC Name]
N-[(3S)-3-(Aminomethyl)-5-methylhexanoyl]-β-D-glucopyranosylamine [ACD/IUPAC Name]
N-[(3S)-3-(Aminométhyl)-5-méthylhexanoyl]-β-D-glucopyranosylamine [French] [ACD/IUPAC Name]
β-D-Glucopyranosylamine, N-[(3S)-3-(aminomethyl)-5-methyl-1-oxohexyl]- [ACD/Index 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: 593.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.6±6.0 kJ/mol
Flash Point: 313.0±30.1 °C
Index of Refraction: 1.554
Molar Refractivity: 79.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -0.25
ACD/LogD (pH 5.5): -3.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 145 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 61.5±5.0 dyne/cm
Molar Volume: 249.4±5.0 cm3

Click to predict properties on the Chemicalize site


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