ChemSpider 2D Image | 3-{4,5-Dimethoxy-2-[(~2~H_3_)methyloxy]phenyl}-8,8-dimethyl-4H,8H-pyrano[2,3-f]chromen-4-one | C23H19D3O6

3-{4,5-Dimethoxy-2-[(2H3)methyloxy]phenyl}-8,8-dimethyl-4H,8H-pyrano[2,3-f]chromen-4-one

  • Molecular FormulaC23H19D3O6
  • Average mass397.436 Da
  • Monoisotopic mass397.160461 Da
  • ChemSpider ID107434613

  • Non-standard isotope - Non-standard isotope

More details:

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

3-{4,5-Dimethoxy-2-[(2H3)methyloxy]phenyl}-8,8-dimethyl-4H,8H-pyrano[2,3-f]chromen-4-on [German] [ACD/IUPAC Name]
3-{4,5-Dimethoxy-2-[(2H3)methyloxy]phenyl}-8,8-dimethyl-4H,8H-pyrano[2,3-f]chromen-4-one [ACD/IUPAC Name]
3-{4,5-Diméthoxy-2-[(2H3)méthyloxy]phényl}-8,8-diméthyl-4H,8H-pyrano[2,3-f]chromén-4-one [French] [ACD/IUPAC Name]
4H,8H-Benzo[1,2-b:3,4-b']dipyran-4-one, 3-[4,5-dimethoxy-2-(methyl-d3-oxy)phenyl]-8,8-dimethyl- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 574.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.1±3.0 kJ/mol
Flash Point: 250.5±30.2 °C
Index of Refraction: 1.581
Molar Refractivity: 106.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 4.47
ACD/BCF (pH 5.5): 1465.16
ACD/KOC (pH 5.5): 6423.02
ACD/LogD (pH 7.4): 4.47
ACD/BCF (pH 7.4): 1465.16
ACD/KOC (pH 7.4): 6423.02
Polar Surface Area: 63 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 320.9±3.0 cm3

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