ChemSpider 2D Image | 2,6-Diamino-2,6-dideoxy-alpha-D-allopyranose | C6H14N2O4

2,6-Diamino-2,6-dideoxy-α-D-allopyranose

  • Molecular FormulaC6H14N2O4
  • Average mass178.186 Da
  • Monoisotopic mass178.095352 Da
  • ChemSpider ID61314094

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2,6-Diamino-2,6-dideoxy-α-D-allopyranose [ACD/IUPAC Name]
2,6-Diamino-2,6-didesoxy-α-D-allopyranose [German] [ACD/IUPAC Name]
2,6-Diamino-2,6-didésoxy-α-D-allopyranose [French] [ACD/IUPAC Name]
α-D-Allopyranose, 2,6-diamino-2,6-dideoxy- [ACD/Index Name]
740022-38-2 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 422.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.2±6.0 kJ/mol
Flash Point: 209.6±28.7 °C
Index of Refraction: 1.598
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: -1.57
ACD/LogD (pH 5.5): -6.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.49
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: 69.1±3.0 dyne/cm
Molar Volume: 120.8±3.0 cm3

Click to predict properties on the Chemicalize site


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