ChemSpider 2D Image | 4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)phenyl 6-deoxy-alpha-L-mannopyranoside | C21H20O9

4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)phenyl 6-deoxy-α-L-mannopyranoside

  • Molecular FormulaC21H20O9
  • Average mass416.378 Da
  • Monoisotopic mass416.110718 Da
  • ChemSpider ID28425498

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)phenyl 6-deoxy-α-L-mannopyranoside [ACD/IUPAC Name]
4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)phenyl-6-desoxy-α-L-mannopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 2-[4-[(6-deoxy-α-L-mannopyranosyl)oxy]phenyl]-5,7-dihydroxy- [ACD/Index Name]
6-Désoxy-α-L-mannopyranoside de 4-(5,7-dihydroxy-4-oxo-4H-chromén-2-yl)phényle [French] [ACD/IUPAC Name]
133538-77-9 [RN]
5,7-dihydroxy-2-[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]chromen-4-one
apigenin 4-o-rhamnoside
Apigenin 4'-O-rhamnoside
MFCD20261054

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 707.4±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 108.6±3.0 kJ/mol
    Flash Point: 252.3±26.4 °C
    Index of Refraction: 1.699
    Molar Refractivity: 102.2±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 5
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 1
    ACD/LogP: 2.29
    ACD/LogD (pH 5.5): 1.66
    ACD/BCF (pH 5.5): 10.43
    ACD/KOC (pH 5.5): 179.27
    ACD/LogD (pH 7.4): 0.51
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 12.76
    Polar Surface Area: 146 Å2
    Polarizability: 40.5±0.5 10-24cm3
    Surface Tension: 82.2±3.0 dyne/cm
    Molar Volume: 264.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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