ChemSpider 2D Image | ascomycone B | C15H12O6

ascomycone B

  • Molecular FormulaC15H12O6
  • Average mass288.252 Da
  • Monoisotopic mass288.063385 Da
  • ChemSpider ID24635627

More details:






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

1,9-Dihydroxy-7-methoxy-3-methyl-1H-benzo[g]isochromen-5,10-dion [German] [ACD/IUPAC Name]
1,9-Dihydroxy-7-methoxy-3-methyl-1H-benzo[g]isochromene-5,10-dione [ACD/IUPAC Name]
1,9-Dihydroxy-7-méthoxy-3-méthyl-1H-benzo[g]isochromène-5,10-dione [French] [ACD/IUPAC Name]
1H-Naphtho[2,3-c]pyran-5,10-dione, 1,9-dihydroxy-7-methoxy-3-methyl- [ACD/Index Name]
ascomycone B

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 621.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.8±3.0 kJ/mol
Flash Point: 240.6±25.0 °C
Index of Refraction: 1.675
Molar Refractivity: 70.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.86
ACD/LogD (pH 5.5): 1.64
ACD/BCF (pH 5.5): 9.88
ACD/KOC (pH 5.5): 170.05
ACD/LogD (pH 7.4): 0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.97
Polar Surface Area: 93 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 73.2±5.0 dyne/cm
Molar Volume: 187.0±5.0 cm3

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