ChemSpider 2D Image | 3-(2,4-Dihydroxyphenyl)-5-methoxy-8,8-dimethyl-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-2-one | C21H20O6

3-(2,4-Dihydroxyphenyl)-5-methoxy-8,8-dimethyl-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-2-one

  • Molecular FormulaC21H20O6
  • Average mass368.380 Da
  • Monoisotopic mass368.125977 Da
  • ChemSpider ID24846665

More details:

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

117038-82-1 [RN]
2H,6H-Benzo[1,2-b:5,4-b']dipyran-2-one, 3-(2,4-dihydroxyphenyl)-7,8-dihydro-5-methoxy-8,8-dimethyl- [ACD/Index Name]
3-(2,4-Dihydroxyphenyl)-5-methoxy-8,8-dimethyl-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-2-on [German] [ACD/IUPAC Name]
3-(2,4-Dihydroxyphenyl)-5-methoxy-8,8-dimethyl-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-2-one [ACD/IUPAC Name]
3-(2,4-Dihydroxyphényl)-5-méthoxy-8,8-diméthyl-7,8-dihydro-2H,6H-pyrano[3,2-g]chromén-2-one [French] [ACD/IUPAC Name]
3-(2,4-DIHYDROXYPHENYL)-5-METHOXY-8,8-DIMETHYL-2H,6H,7H,8H-PYRANO[3,2-G]CHROMEN-2-ONE
3-(2,4-Dihydroxyphenyl)-7,8-dihydro-5-methoxy-8,8-dimethyl-2H,6H-benzo[1,2-b:5,4-b']bipyran-2-one, 9CI
6-(2,4-dihydroxyphenyl)-9-methoxy-13,13-dimethyl-4,14-dioxatricyclo[8.4.0.0??,?]tetradeca-1(10),2,6,8-tetraen-5-one
6-(2,4-dihydroxyphenyl)-9-methoxy-13,13-dimethyl-4,14-dioxatricyclo[8.4.0.0³,⁸]tetradeca-1(10),2,6,8-tetraen-5-one
7-(2,4-dihydroxyphenyl)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[3,2-g]chromen-8-one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.3±0.1 g/cm3
Boiling Point: 620.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.3±3.0 kJ/mol
Flash Point: 223.2±25.0 °C
Index of Refraction: 1.625
Molar Refractivity: 97.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.45
ACD/LogD (pH 5.5): 4.94
ACD/BCF (pH 5.5): 3338.42
ACD/KOC (pH 5.5): 11579.28
ACD/LogD (pH 7.4): 4.92
ACD/BCF (pH 7.4): 3208.83
ACD/KOC (pH 7.4): 11129.81
Polar Surface Area: 85 Å2
Polarizability: 38.8±0.5 10-24cm3
Surface Tension: 53.8±3.0 dyne/cm
Molar Volume: 276.4±3.0 cm3

Click to predict properties on the Chemicalize site


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