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Search term: 24845384 (Found by CSID)
ChemSpider 2D Image | 4-(5,7-Dihydroxy-3-methoxy-4-oxo-4H-chromen-2-yl)-2-methoxyphenyl 3-methylbutanoate | C22H22O8

4-(5,7-Dihydroxy-3-methoxy-4-oxo-4H-chromen-2-yl)-2-methoxyphenyl 3-methylbutanoate

  • Molecular FormulaC22H22O8
  • Average mass414.405 Da
  • Monoisotopic mass414.131470 Da
  • ChemSpider ID24845384

More details:

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

3-Méthylbutanoate de 4-(5,7-dihydroxy-3-méthoxy-4-oxo-4H-chromén-2-yl)-2-méthoxyphényle [French] [ACD/IUPAC Name]
4-(5,7-Dihydroxy-3-methoxy-4-oxo-4H-chromen-2-yl)-2-methoxyphenyl 3-methylbutanoate [ACD/IUPAC Name]
4-(5,7-Dihydroxy-3-methoxy-4-oxo-4H-chromen-2-yl)-2-methoxyphenyl-3-methylbutanoat [German] [ACD/IUPAC Name]
Butanoic acid, 3-methyl-, 4-(5,7-dihydroxy-3-methoxy-4-oxo-4H-1-benzopyran-2-yl)-2-methoxyphenyl ester [ACD/Index 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: 592.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.6±3.0 kJ/mol
Flash Point: 205.2±23.6 °C
Index of Refraction: 1.623
Molar Refractivity: 105.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.18
ACD/LogD (pH 5.5): 3.49
ACD/BCF (pH 5.5): 249.59
ACD/KOC (pH 5.5): 1703.34
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 10.77
ACD/KOC (pH 7.4): 73.49
Polar Surface Area: 112 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 63.5±5.0 dyne/cm
Molar Volume: 298.9±5.0 cm3

Click to predict properties on the Chemicalize site


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