ChemSpider 2D Image | 6,6'-Dihydroxy-9,9'-dimethoxy-3,3'-dimethyl-3,3',4,4'-tetrahydro-1H,1'H-8,8'-bibenzo[h]isochromene-1,1',7,7',10,10'-hexone | C30H22O12

6,6'-Dihydroxy-9,9'-dimethoxy-3,3'-dimethyl-3,3',4,4'-tetrahydro-1H,1'H-8,8'-bibenzo[h]isochromene-1,1',7,7',10,10'-hexone

  • Molecular FormulaC30H22O12
  • Average mass574.489 Da
  • Monoisotopic mass574.111145 Da
  • ChemSpider ID10222342

More details:

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

[8,8'-Bi-1H-naphtho[1,2-c]pyran]-1,1',7,7',10,10'-hexone, 3,3',4,4'-tetrahydro-6,6'-dihydroxy-9,9'-dimethoxy-3,3'-dimethyl- [ACD/Index Name]
6,6'-Dihydroxy-9,9'-dimethoxy-3,3'-dimethyl-3,3',4,4'-tetrahydro-1H,1'H-8,8'-bibenzo[h]isochromen-1,1',7,7',10,10'-hexon [German] [ACD/IUPAC Name]
6,6'-Dihydroxy-9,9'-dimethoxy-3,3'-dimethyl-3,3',4,4'-tetrahydro-1H,1'H-8,8'-bibenzo[h]isochromene-1,1',7,7',10,10'-hexone [ACD/IUPAC Name]
6,6'-Dihydroxy-9,9'-diméthoxy-3,3'-diméthyl-3,3',4,4'-tétrahydro-1H,1'H-8,8'-bibenzo[h]isochromène-1,1',7,7',10,10'-hexone [French] [ACD/IUPAC Name]
1685-91-2 [RN]
xanthomegnin

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

Density: 1.6±0.1 g/cm3
Boiling Point: 986.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 148.7±3.0 kJ/mol
Flash Point: 329.8±27.8 °C
Index of Refraction: 1.705
Molar Refractivity: 136.2±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 2.03
ACD/BCF (pH 5.5): 5.83
ACD/KOC (pH 5.5): 27.75
ACD/LogD (pH 7.4): 0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 180 Å2
Polarizability: 54.0±0.5 10-24cm3
Surface Tension: 86.5±5.0 dyne/cm
Molar Volume: 350.5±5.0 cm3

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