Found 10 results

Search term: MF = 'C_{31}H_{30}O_{14}'
ChemSpider 2D Image | 3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-chromen-7-yl 2,3,4,6-tetra-O-acetyl-beta-D-glucopyranoside | C31H30O14

3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-chromen-7-yl 2,3,4,6-tetra-O-acetyl-β-D-glucopyranoside

  • Molecular FormulaC31H30O14
  • Average mass626.562 Da
  • Monoisotopic mass626.163574 Da
  • ChemSpider ID10390450

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2,3,4,6-Tétra-O-acétyl-β-D-glucopyranoside de 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-chromén-7-yle [French] [ACD/IUPAC Name]
3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-chromen-7-yl 2,3,4,6-tetra-O-acetyl-β-D-glucopyranoside [ACD/IUPAC Name]
3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-chromen-7-yl-2,3,4,6-tetra-O-acetyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]- [ACD/Index Name]
[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl acetate
121060-08-0 [RN]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 715.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 104.5±3.0 kJ/mol
    Flash Point: 297.7±32.9 °C
    Index of Refraction: 1.602
    Molar Refractivity: 149.1±0.4 cm3
    #H bond acceptors: 14
    #H bond donors: 0
    #Freely Rotating Bonds: 12
    #Rule of 5 Violations: 2
    ACD/LogP: 4.04
    ACD/LogD (pH 5.5): 3.38
    ACD/BCF (pH 5.5): 219.78
    ACD/KOC (pH 5.5): 1651.97
    ACD/LogD (pH 7.4): 3.38
    ACD/BCF (pH 7.4): 219.78
    ACD/KOC (pH 7.4): 1651.97
    Polar Surface Area: 168 Å2
    Polarizability: 59.1±0.5 10-24cm3
    Surface Tension: 63.3±5.0 dyne/cm
    Molar Volume: 434.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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