ChemSpider 2D Image | 1,2,3,6-Tetra-O-benzoyl-4-deoxy-4-fluoro-alpha-D-mannopyranose | C34H27FO9

1,2,3,6-Tetra-O-benzoyl-4-deoxy-4-fluoro-α-D-mannopyranose

  • Molecular FormulaC34H27FO9
  • Average mass598.571 Da
  • Monoisotopic mass598.163940 Da
  • ChemSpider ID35466949

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

1,2,3,6-Tetra-O-benzoyl-4-deoxy-4-fluoro-α-D-mannopyranose [ACD/IUPAC Name]
1,2,3,6-Tétra-O-benzoyl-4-désoxy-4-fluoro-α-D-mannopyranose [French] [ACD/IUPAC Name]
1,2,3,6-Tetra-O-benzoyl-4-desoxy-4-fluor-α-D-mannopyranose [German] [ACD/IUPAC Name]
α-D-Mannopyranose, 4-deoxy-4-fluoro-, tetrabenzoate [ACD/Index Name]
(2R,3S,4R,5R,6R)-6-((Benzoyloxy)methyl)-5-fluorotetrahydro-2H-pyran-2,3,4-triyl tribenzoate
1,2,3,6-Tetra-O-benzoyl-4-deoxy-4-fluoro-a-D-mannopyranose
1309463-38-4 [RN]
4-Deoxy-4-fluoro-1,2,3,6-tetra-O-benzoyl-|A-D-mannose
MFCD07369279

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 699.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 102.5±3.0 kJ/mol
    Flash Point: 362.8±26.4 °C
    Index of Refraction: 1.624
    Molar Refractivity: 154.3±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 0
    #Freely Rotating Bonds: 13
    #Rule of 5 Violations: 2
    ACD/LogP: 9.51
    ACD/LogD (pH 5.5): 7.59
    ACD/BCF (pH 5.5): 347340.00
    ACD/KOC (pH 5.5): 321844.16
    ACD/LogD (pH 7.4): 7.59
    ACD/BCF (pH 7.4): 347340.00
    ACD/KOC (pH 7.4): 321844.16
    Polar Surface Area: 114 Å2
    Polarizability: 61.2±0.5 10-24cm3
    Surface Tension: 60.3±5.0 dyne/cm
    Molar Volume: 437.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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