ChemSpider 2D Image | 2,2'-[(2,3-Dimethoxyphenyl)methylene]bis(3-hydroxy-6-methyl-4H-pyran-4-one) | C21H20O8

2,2'-[(2,3-Dimethoxyphenyl)methylene]bis(3-hydroxy-6-methyl-4H-pyran-4-one)

  • Molecular FormulaC21H20O8
  • Average mass400.379 Da
  • Monoisotopic mass400.115814 Da
  • ChemSpider ID29770295

More details:






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

2,2'-[(2,3-Dimethoxyphenyl)methylen]bis(3-hydroxy-6-methyl-4H-pyran-4-on) [German] [ACD/IUPAC Name]
2,2'-[(2,3-Dimethoxyphenyl)methylene]bis(3-hydroxy-6-methyl-4H-pyran-4-one) [ACD/IUPAC Name]
2,2'-[(2,3-Diméthoxyphényl)méthylène]bis(3-hydroxy-6-méthyl-4H-pyran-4-one) [French] [ACD/IUPAC Name]
4H-Pyran-4-one, 2,2'-[(2,3-dimethoxyphenyl)methylene]bis[3-hydroxy-6-methyl- [ACD/Index Name]
1435904-60-1 [RN]
2-[(2,3-dimethoxyphenyl)-(3-hydroxy-6-methyl-4-oxopyran-2-yl)methyl]-3-hydroxy-6-methylpyran-4-one
C21H20O8

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

Density: 1.4±0.1 g/cm3
Boiling Point: 651.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.8±3.0 kJ/mol
Flash Point: 231.1±25.0 °C
Index of Refraction: 1.634
Molar Refractivity: 101.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.28
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 5.24
ACD/KOC (pH 5.5): 113.81
ACD/LogD (pH 7.4): 1.10
ACD/BCF (pH 7.4): 3.73
ACD/KOC (pH 7.4): 80.87
Polar Surface Area: 112 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 62.2±3.0 dyne/cm
Molar Volume: 282.7±3.0 cm3

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