ChemSpider 2D Image | 4-(5,7-Dihydroxy-3,6-dimethoxy-2',2'-dimethyl-4-oxo-3',4'-dihydro-2'H,4H-2,6'-bichromen-8'-yl)-2-methylbutyl formate | C28H32O9

4-(5,7-Dihydroxy-3,6-dimethoxy-2',2'-dimethyl-4-oxo-3',4'-dihydro-2'H,4H-2,6'-bichromen-8'-yl)-2-methylbutyl formate

  • Molecular FormulaC28H32O9
  • Average mass512.548 Da
  • Monoisotopic mass512.204651 Da
  • ChemSpider ID29361377

More details:

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

[2,6'-Bi-4H-1-benzopyran]-4-one, 8'-[4-(formyloxy)-3-methylbutyl]-2',3'-dihydro-5,7-dihydroxy-3,6-dimethoxy-2',2'-dimethyl- [ACD/Index Name]
4-(5,7-Dihydroxy-3,6-dimethoxy-2',2'-dimethyl-4-oxo-3',4'-dihydro-2'H,4H-2,6'-bichromen-8'-yl)-2-methylbutyl formate [ACD/IUPAC Name]
4-(5,7-Dihydroxy-3,6-dimethoxy-2',2'-dimethyl-4-oxo-3',4'-dihydro-2'H,4H-2,6'-bichromen-8'-yl)-2-methylbutylformiat [German] [ACD/IUPAC Name]
Formiate de 4-(5,7-dihydroxy-3,6-diméthoxy-2',2'-diméthyl-4-oxo-3',4'-dihydro-2'H,4H-2,6'-bichromén-8'-yl)-2-méthylbutyle [French] [ACD/IUPAC Name]
1392213-93-2 [RN]
92280-12-1 [RN]
Dodonaflavonol
MFCD23103576
Sanggenon N

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 722.7±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 109.3±3.0 kJ/mol
    Flash Point: 238.9±26.4 °C
    Index of Refraction: 1.613
    Molar Refractivity: 133.1±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 1
    ACD/LogP: 4.75
    ACD/LogD (pH 5.5): 4.40
    ACD/BCF (pH 5.5): 1241.42
    ACD/KOC (pH 5.5): 5380.92
    ACD/LogD (pH 7.4): 3.06
    ACD/BCF (pH 7.4): 56.06
    ACD/KOC (pH 7.4): 242.99
    Polar Surface Area: 121 Å2
    Polarizability: 52.8±0.5 10-24cm3
    Surface Tension: 61.7±5.0 dyne/cm
    Molar Volume: 382.3±5.0 cm3

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