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Search term: C[C@@H]1OC(O)[C@H](N)[C@@H](O)[C@H]1N (Found by conversion of search term to chemical structure (connectivity match))
ChemSpider 2D Image | 2,4-Diamino-2,4,6-trideoxy-D-glucopyranose | C6H14N2O3

2,4-Diamino-2,4,6-trideoxy-D-glucopyranose

  • Molecular FormulaC6H14N2O3
  • Average mass162.187 Da
  • Monoisotopic mass162.100449 Da
  • ChemSpider ID67173482

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

2,4-Diamino-2,4,6-trideoxy-D-glucopyranose [ACD/IUPAC Name]
2,4-Diamino-2,4,6-tridesoxy-D-glucopyranose [German] [ACD/IUPAC Name]
2,4-Diamino-2,4,6-tridésoxy-D-glucopyranose [French] [ACD/IUPAC Name]
D-Glucopyranose, 2,4-diamino-2,4,6-trideoxy- [ACD/Index Name]
Bacillosamine [Wiki]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 359.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 70.0±6.0 kJ/mol
Flash Point: 171.2±27.9 °C
Index of Refraction: 1.539
Molar Refractivity: 39.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 6
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: -1.38
ACD/LogD (pH 5.5): -6.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 15.7±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 126.6±3.0 cm3

Click to predict properties on the Chemicalize site


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