ChemSpider 2D Image | 2-(5,7-Dimethoxy-4-oxo-4H-chromen-2-yl)phenyl 4-methylbenzenesulfonate | C24H20O7S

2-(5,7-Dimethoxy-4-oxo-4H-chromen-2-yl)phenyl 4-methylbenzenesulfonate

  • Molecular FormulaC24H20O7S
  • Average mass452.476 Da
  • Monoisotopic mass452.092987 Da
  • ChemSpider ID24740460

More details:

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

2-(5,7-Dimethoxy-4-oxo-4H-chromen-2-yl)phenyl 4-methylbenzenesulfonate [ACD/IUPAC Name]
2-(5,7-Dimethoxy-4-oxo-4H-chromen-2-yl)phenyl-4-methylbenzolsulfonat [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 5,7-dimethoxy-2-[2-[[(4-methylphenyl)sulfonyl]oxy]phenyl]- [ACD/Index Name]
4-Méthylbenzènesulfonate de 2-(5,7-diméthoxy-4-oxo-4H-chromén-2-yl)phényle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 665.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 356.4±31.5 °C
Index of Refraction: 1.614
Molar Refractivity: 117.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.57
ACD/LogD (pH 5.5): 4.15
ACD/BCF (pH 5.5): 836.64
ACD/KOC (pH 5.5): 4300.85
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 836.64
ACD/KOC (pH 7.4): 4300.85
Polar Surface Area: 97 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 51.5±3.0 dyne/cm
Molar Volume: 337.2±3.0 cm3

Click to predict properties on the Chemicalize site


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