ChemSpider 2D Image | Methyl 4,6-O-benzylidene-beta-D-glucopyranoside | C14H18O6

Methyl 4,6-O-benzylidene-β-D-glucopyranoside

  • Molecular FormulaC14H18O6
  • Average mass282.289 Da
  • Monoisotopic mass282.110352 Da
  • ChemSpider ID20193592

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

14155-23-8 [RN]
4,6-O-Benzylidène-β-D-glucopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl 4,6-O-benzylidene-β-D-glucopyranoside [ACD/IUPAC Name]
Methyl-4,6-O-benzyliden-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside, methyl 4,6-O-(phenylmethylene)- [ACD/Index Name]
(4aR,6R,7R,8R,8aS)-6-Methoxy-2-phenylhexahydropyrano[3,2-d][1,3]dioxine-7,8-diol
[14155-23-8] [RN]
221-615-2 [EINECS]
CID 12245491
Methyl 4,6-O-benzylidene-b-D-glucopyranoside
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 473.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 77.5±3.0 kJ/mol
    Flash Point: 239.8±28.7 °C
    Index of Refraction: 1.586
    Molar Refractivity: 69.6±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.89
    ACD/LogD (pH 5.5): 0.89
    ACD/BCF (pH 5.5): 2.79
    ACD/KOC (pH 5.5): 72.51
    ACD/LogD (pH 7.4): 0.89
    ACD/BCF (pH 7.4): 2.79
    ACD/KOC (pH 7.4): 72.51
    Polar Surface Area: 77 Å2
    Polarizability: 27.6±0.5 10-24cm3
    Surface Tension: 56.5±5.0 dyne/cm
    Molar Volume: 207.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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