ChemSpider 2D Image | (5xi)-5-Thio-beta-D-lyxo-hexopyranosylamine | C6H13NO4S

(5ξ)-5-Thio-β-D-lyxo-hexopyranosylamine

  • Molecular FormulaC6H13NO4S
  • Average mass195.237 Da
  • Monoisotopic mass195.056534 Da
  • ChemSpider ID61579477

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(5ξ)-5-Thio-β-D-lyxo-hexopyranosylamin [German] [ACD/IUPAC Name]
(5ξ)-5-Thio-β-D-lyxo-hexopyranosylamine [ACD/IUPAC Name]
(5ξ)-5-Thio-β-D-lyxo-hexopyranosylamine [French] [ACD/IUPAC Name]
β-D-lyxo-Hexopyranosylamine, 5-thio-, (5ξ)- [ACD/Index Name]
2089586-97-8 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 407.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.2±6.0 kJ/mol
Flash Point: 200.4±28.7 °C
Index of Refraction: 1.667
Molar Refractivity: 45.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 6
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: -1.22
ACD/LogD (pH 5.5): -4.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 18.1±0.5 10-24cm3
Surface Tension: 79.0±3.0 dyne/cm
Molar Volume: 123.0±3.0 cm3

Click to predict properties on the Chemicalize site


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