ChemSpider 2D Image | 3-(3,5-Dimethylphenoxy)-4-oxo-4H-chromen-7-yl 3,4,5-triethoxybenzoate | C30H30O8

3-(3,5-Dimethylphenoxy)-4-oxo-4H-chromen-7-yl 3,4,5-triethoxybenzoate

  • Molecular FormulaC30H30O8
  • Average mass518.554 Da
  • Monoisotopic mass518.194092 Da
  • ChemSpider ID1354313

More details:






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

3-(3,5-Dimethylphenoxy)-4-oxo-4H-chromen-7-yl 3,4,5-triethoxybenzoate [ACD/IUPAC Name]
3-(3,5-Dimethylphenoxy)-4-oxo-4H-chromen-7-yl-3,4,5-triethoxybenzoat [German] [ACD/IUPAC Name]
3,4,5-Triéthoxybenzoate de 3-(3,5-diméthylphénoxy)-4-oxo-4H-chromén-7-yle [French] [ACD/IUPAC Name]
Benzoic acid, 3,4,5-triethoxy-, 3-(3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 618.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 260.8±31.5 °C
Index of Refraction: 1.584
Molar Refractivity: 141.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.98
ACD/LogD (pH 5.5): 6.12
ACD/BCF (pH 5.5): 26291.60
ACD/KOC (pH 5.5): 50732.92
ACD/LogD (pH 7.4): 6.12
ACD/BCF (pH 7.4): 26291.60
ACD/KOC (pH 7.4): 50732.92
Polar Surface Area: 90 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 422.1±3.0 cm3

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