ChemSpider 2D Image | 5-Hydroxy-7-(4-hydroxyphenyl)-6-methoxy-1H,3H-benzo[de]isochromene-1,3-dione | C19H12O6

5-Hydroxy-7-(4-hydroxyphenyl)-6-methoxy-1H,3H-benzo[de]isochromene-1,3-dione

  • Molecular FormulaC19H12O6
  • Average mass336.295 Da
  • Monoisotopic mass336.063385 Da
  • ChemSpider ID24629077

More details:






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

1H,3H-Naphtho[1,8-cd]pyran-1,3-dione, 5-hydroxy-7-(4-hydroxyphenyl)-6-methoxy- [ACD/Index Name]
5-Hydroxy-7-(4-hydroxyphenyl)-6-methoxy-1H,3H-benzo[de]isochromen-1,3-dion [German] [ACD/IUPAC Name]
5-Hydroxy-7-(4-hydroxyphenyl)-6-methoxy-1H,3H-benzo[de]isochromene-1,3-dione [ACD/IUPAC Name]
5-Hydroxy-7-(4-hydroxyphényl)-6-méthoxy-1H,3H-benzo[de]isochromène-1,3-dione [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 633.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.1±3.0 kJ/mol
Flash Point: 237.0±25.0 °C
Index of Refraction: 1.726
Molar Refractivity: 88.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.70
ACD/LogD (pH 5.5): 2.15
ACD/BCF (pH 5.5): 24.95
ACD/KOC (pH 5.5): 338.38
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 2.94
ACD/KOC (pH 7.4): 39.91
Polar Surface Area: 93 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 72.0±3.0 dyne/cm
Molar Volume: 222.8±3.0 cm3

Click to predict properties on the Chemicalize site






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