ChemSpider 2D Image | Dimethyl 5-[5-(5-hydroxy-4,8-dioxo-3-phenyl-9,10-dihydro-4H,8H-pyrano[2,3-f]chromen-10-yl)-2-furyl]isophthalate | C32H22O10

Dimethyl 5-[5-(5-hydroxy-4,8-dioxo-3-phenyl-9,10-dihydro-4H,8H-pyrano[2,3-f]chromen-10-yl)-2-furyl]isophthalate

  • Molecular FormulaC32H22O10
  • Average mass566.511 Da
  • Monoisotopic mass566.121277 Da
  • ChemSpider ID58173314

More details:

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

1,3-Benzenedicarboxylic acid, 5-[5-(9,10-dihydro-5-hydroxy-4,8-dioxo-3-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-10-yl)-2-furanyl]-, dimethyl ester [ACD/Index Name]
5-[5-(5-Hydroxy-4,8-dioxo-3-phényl-9,10-dihydro-4H,8H-pyrano[2,3-f]chromén-10-yl)-2-furyl]isophtalate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5-[5-(5-hydroxy-4,8-dioxo-3-phenyl-9,10-dihydro-4H,8H-pyrano[2,3-f]chromen-10-yl)-2-furyl]isophthalate [ACD/IUPAC Name]
Dimethyl-5-[5-(5-hydroxy-4,8-dioxo-3-phenyl-9,10-dihydro-4H,8H-pyrano[2,3-f]chromen-10-yl)-2-furyl]isophthalat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 756.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.1±3.0 kJ/mol
Flash Point: 411.3±32.9 °C
Index of Refraction: 1.644
Molar Refractivity: 144.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 6.28
ACD/LogD (pH 5.5): 5.56
ACD/BCF (pH 5.5): 8876.51
ACD/KOC (pH 5.5): 20660.02
ACD/LogD (pH 7.4): 4.12
ACD/BCF (pH 7.4): 323.62
ACD/KOC (pH 7.4): 753.23
Polar Surface Area: 139 Å2
Polarizability: 57.4±0.5 10-24cm3
Surface Tension: 59.3±3.0 dyne/cm
Molar Volume: 400.1±3.0 cm3

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