ChemSpider 2D Image | 5-Hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl-4H,8H-pyrano[2,3-f]chromen-4-one | C20H16O5

5-Hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl-4H,8H-pyrano[2,3-f]chromen-4-one

  • Molecular FormulaC20H16O5
  • Average mass336.338 Da
  • Monoisotopic mass336.099762 Da
  • ChemSpider ID23301900

More details:

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

4H,8H-Benzo[1,2-b:3,4-b']dipyran-4-one, 5-hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl- [ACD/Index Name]
5-Hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl-4H,8H-pyrano[2,3-f]chromen-4-on [German] [ACD/IUPAC Name]
5-Hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl-4H,8H-pyrano[2,3-f]chromen-4-one [ACD/IUPAC Name]
5-Hydroxy-3-(4-hydroxyphényl)-8,8-diméthyl-4H,8H-pyrano[2,3-f]chromén-4-one [French] [ACD/IUPAC Name]
[76166-59-1] [RN]
5-hydroxy-3-(4-hydroxy-phenyl)-8,8-dimethyl-8H-pyrano[2,3-f]chromen-4-one
76166-59-1 [RN]
Derrone
MFCD22417277

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

Density: 1.4±0.1 g/cm3
Boiling Point: 584.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.5±3.0 kJ/mol
Flash Point: 214.6±23.6 °C
Index of Refraction: 1.660
Molar Refractivity: 90.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 5.53
ACD/LogD (pH 5.5): 4.92
ACD/BCF (pH 5.5): 3160.88
ACD/KOC (pH 5.5): 10836.91
ACD/LogD (pH 7.4): 4.01
ACD/BCF (pH 7.4): 386.54
ACD/KOC (pH 7.4): 1325.23
Polar Surface Area: 76 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 245.7±3.0 cm3

Click to predict properties on the Chemicalize site


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