ChemSpider 2D Image | 6'-Acetyl-5'-hydroxy-6-methoxy-3',4'-dihydro-2'H,4H-3,4'-bichromene-2',4-dione | C21H16O7

6'-Acetyl-5'-hydroxy-6-methoxy-3',4'-dihydro-2'H,4H-3,4'-bichromene-2',4-dione

  • Molecular FormulaC21H16O7
  • Average mass380.348 Da
  • Monoisotopic mass380.089600 Da
  • ChemSpider ID32512421

More details:

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

[3,4'-Bi-4H-1-benzopyran]-2',4(3'H)-dione, 6'-acetyl-5'-hydroxy-6-methoxy- [ACD/Index Name]
6'-Acetyl-5'-hydroxy-6-methoxy-3',4'-dihydro-2'H,4H-3,4'-bichromen-2',4-dion [German] [ACD/IUPAC Name]
6'-Acetyl-5'-hydroxy-6-methoxy-3',4'-dihydro-2'H,4H-3,4'-bichromene-2',4-dione [ACD/IUPAC Name]
6'-Acétyl-5'-hydroxy-6-méthoxy-3',4'-dihydro-2'H,4H-3,4'-bichromène-2',4-dione [French] [ACD/IUPAC Name]
1630823-69-6 [RN]
3-(6-acetyl-5-hydroxy-2-oxo-3,4-dihydrochromen-4-yl)-6-methoxychromen-4-one
MolPort-035-702-061

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 530.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 83.6±3.0 kJ/mol
    Flash Point: 187.9±23.6 °C
    Index of Refraction: 1.645
    Molar Refractivity: 96.6±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.77
    ACD/LogD (pH 5.5): 3.20
    ACD/BCF (pH 5.5): 159.60
    ACD/KOC (pH 5.5): 1313.69
    ACD/LogD (pH 7.4): 3.19
    ACD/BCF (pH 7.4): 155.96
    ACD/KOC (pH 7.4): 1283.76
    Polar Surface Area: 99 Å2
    Polarizability: 38.3±0.5 10-24cm3
    Surface Tension: 61.2±3.0 dyne/cm
    Molar Volume: 266.5±3.0 cm3

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