ChemSpider 2D Image | 6-O-Feruloylglucose | C16H20O9

6-O-Feruloylglucose

  • Molecular FormulaC16H20O9
  • Average mass356.325 Da
  • Monoisotopic mass356.110718 Da
  • ChemSpider ID29365118

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

137887-25-3 [RN]
6-O-[(2E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoyl]-D-glucose [German] [ACD/IUPAC Name]
6-O-[(2E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoyl]-D-glucose [ACD/IUPAC Name]
6-O-[(2E)-3-(4-Hydroxy-3-méthoxyphényl)-2-propenoyl]-D-glucose [French] [ACD/IUPAC Name]
6-O-Feruloylglucose
D-Glucose, 6-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propen-1-yl]- [ACD/Index Name]
(2R,3R,4S,5R)-2,3,4,5-Tetrahydroxy-6-oxohexyl 3-(4-hydroxy-3-methoxyphenyl)acrylate
[137887-25-3] [RN]
6-O-(e)-feruloyl-glucose
6-O-[(2E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoyl]-D-glucopyranose [ACD/IUPAC Name]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 684.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 105.5±3.0 kJ/mol
    Flash Point: 250.5±25.0 °C
    Index of Refraction: 1.626
    Molar Refractivity: 86.4±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 5
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 1
    ACD/LogP: -0.47
    ACD/LogD (pH 5.5): -0.29
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 16.53
    ACD/LogD (pH 7.4): -0.29
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 16.46
    Polar Surface Area: 154 Å2
    Polarizability: 34.3±0.5 10-24cm3
    Surface Tension: 71.7±3.0 dyne/cm
    Molar Volume: 244.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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