ChemSpider 2D Image | Methyl 9,10,11-trihydroxy-12-oxo-6,12-dihydrochromeno[3,4-b]chromen-6-yl carbonate | C18H12O9

Methyl 9,10,11-trihydroxy-12-oxo-6,12-dihydrochromeno[3,4-b]chromen-6-yl carbonate

  • Molecular FormulaC18H12O9
  • Average mass372.283 Da
  • Monoisotopic mass372.048126 Da
  • ChemSpider ID24842975

More details:

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

Carbonate de méthyle et de 9,10,11-trihydroxy-12-oxo-6,12-dihydrochroméno[3,4-b]chromén-6-yle [French] [ACD/IUPAC Name]
Carbonic acid, 6,12-dihydro-9,10,11-trihydroxy-12-oxo[1]benzopyrano[3,4-b][1]benzopyran-6-yl methyl ester [ACD/Index Name]
Methyl 9,10,11-trihydroxy-12-oxo-6,12-dihydrochromeno[3,4-b]chromen-6-yl carbonate [ACD/IUPAC Name]
Methyl-9,10,11-trihydroxy-12-oxo-6,12-dihydrochromeno[3,4-b]chromen-6-ylcarbonat [German] [ACD/IUPAC Name]
6a,12a-Dehydro-9,10,11-trihydroxy-6-acetoxyrotenone
Repenone

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

Density: 1.8±0.1 g/cm3
Boiling Point: 734.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.0±3.0 kJ/mol
Flash Point: 273.1±26.4 °C
Index of Refraction: 1.746
Molar Refractivity: 86.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 3.11
ACD/BCF (pH 5.5): 132.38
ACD/KOC (pH 5.5): 1117.49
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 13.72
ACD/KOC (pH 7.4): 115.81
Polar Surface Area: 132 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 98.8±5.0 dyne/cm
Molar Volume: 212.8±5.0 cm3

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