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Search term: N[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1N (Found by conversion of search term to chemical structure (connectivity match))

ChemSpider 2D Image | 2-Amino-2-deoxy-D-glucopyranosylamine | C6H14N2O4

2-Amino-2-deoxy-D-glucopyranosylamine

  • Molecular FormulaC6H14N2O4
  • Average mass178.186 Da
  • Monoisotopic mass178.095352 Da
  • ChemSpider ID61406512
  • defined stereocentres - 4 of 5 defined stereocentres


More details:






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

2-Amino-2-deoxy-D-glucopyranosylamine [ACD/IUPAC Name]
2-Amino-2-desoxy-D-glucopyranosylamin [German] [ACD/IUPAC Name]
2-Amino-2-désoxy-D-glucopyranosylamine [French] [ACD/IUPAC Name]
D-Glucopyranosylamine, 2-amino-2-deoxy- [ACD/Index Name]
103172-84-5 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 412.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.9±6.0 kJ/mol
Flash Point: 203.4±28.7 °C
Index of Refraction: 1.572
Molar Refractivity: 41.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 7
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: -1.59
ACD/LogD (pH 5.5): -5.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 122 Å2
Polarizability: 16.3±0.5 10-24cm3
Surface Tension: 67.7±3.0 dyne/cm
Molar Volume: 125.2±3.0 cm3

Click to predict properties on the Chemicalize site






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