ChemSpider 2D Image | Methyl {4,8-dimethyl-2-oxo-7-[(2,3,5,6-tetramethylbenzyl)oxy]-2H-chromen-3-yl}acetate | C25H28O5

Methyl {4,8-dimethyl-2-oxo-7-[(2,3,5,6-tetramethylbenzyl)oxy]-2H-chromen-3-yl}acetate

  • Molecular FormulaC25H28O5
  • Average mass408.487 Da
  • Monoisotopic mass408.193665 Da
  • ChemSpider ID21750038

More details:

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

{4,8-Diméthyl-2-oxo-7-[(2,3,5,6-tétraméthylbenzyl)oxy]-2H-chromén-3-yl}acétate de méthyle [French] [ACD/IUPAC Name]
2H-1-Benzopyran-3-acetic acid, 4,8-dimethyl-2-oxo-7-[(2,3,5,6-tetramethylphenyl)methoxy]-, methyl ester [ACD/Index Name]
Methyl {4,8-dimethyl-2-oxo-7-[(2,3,5,6-tetramethylbenzyl)oxy]-2H-chromen-3-yl}acetate [ACD/IUPAC Name]
Methyl-{4,8-dimethyl-2-oxo-7-[(2,3,5,6-tetramethylbenzyl)oxy]-2H-chromen-3-yl}acetat [German] [ACD/IUPAC Name]
[4,8-Dimethyl-2-oxo-7-(2,3,5,6-tetramethyl-benzyloxy)-2H-chromen-3-yl]-acetic acid methyl ester
methyl 2-(4,8-dimethyl-2-oxo-7-((2,3,5,6-tetramethylbenzyl)oxy)-2H-chromen-3-yl)acetate
methyl 2-{4,8-dimethyl-2-oxo-7-[(2,3,5,6-tetramethylphenyl)methoxy]chromen-3-yl}acetate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 567.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.1±3.0 kJ/mol
Flash Point: 244.2±30.2 °C
Index of Refraction: 1.561
Molar Refractivity: 115.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.65
ACD/LogD (pH 5.5): 6.13
ACD/BCF (pH 5.5): 26937.63
ACD/KOC (pH 5.5): 51622.17
ACD/LogD (pH 7.4): 6.13
ACD/BCF (pH 7.4): 26937.63
ACD/KOC (pH 7.4): 51622.17
Polar Surface Area: 62 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 356.7±3.0 cm3

Click to predict properties on the Chemicalize site


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