ChemSpider 2D Image | (5xi)-1-Amino-1-deoxy-D-threo-hex-2-ulofuranose | C6H13NO5

(5ξ)-1-Amino-1-deoxy-D-threo-hex-2-ulofuranose

  • Molecular FormulaC6H13NO5
  • Average mass179.171 Da
  • Monoisotopic mass179.079376 Da
  • ChemSpider ID75681131

  • defined stereocentres - 2 of 4 defined stereocentres

More details:

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

(5ξ)-1-Amino-1-deoxy-D-threo-hex-2-ulofuranose [ACD/IUPAC Name]
(5ξ)-1-Amino-1-desoxy-D-threo-hex-2-ulofuranose [German] [ACD/IUPAC Name]
(5ξ)-1-Amino-1-désoxy-D-thréo-hex-2-ulofuranose [French] [ACD/IUPAC Name]
D-threo-2-Hexulofuranose, 1-amino-1-deoxy-, (5ξ)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 412.5±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: 203.3±28.7 °C
Index of Refraction: 1.614
Molar Refractivity: 39.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.46
ACD/LogD (pH 5.5): -5.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 116 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 87.3±3.0 dyne/cm
Molar Volume: 112.5±3.0 cm3

Click to predict properties on the Chemicalize site


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