ChemSpider 2D Image | Methyl {4-methyl-5,7-bis[(2-methyl-2-propen-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetate | C21H24O6

Methyl {4-methyl-5,7-bis[(2-methyl-2-propen-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetate

  • Molecular FormulaC21H24O6
  • Average mass372.412 Da
  • Monoisotopic mass372.157288 Da
  • ChemSpider ID21674465

More details:






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

{4-Méthyl-5,7-bis[(2-méthyl-2-propén-1-yl)oxy]-2-oxo-2H-chromén-3-yl}acétate de méthyle [French] [ACD/IUPAC Name]
2H-1-Benzopyran-3-acetic acid, 4-methyl-5,7-bis[(2-methyl-2-propen-1-yl)oxy]-2-oxo-, methyl ester [ACD/Index Name]
Methyl {4-methyl-5,7-bis[(2-methyl-2-propen-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetate [ACD/IUPAC Name]
Methyl-{4-methyl-5,7-bis[(2-methyl-2-propen-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetat [German] [ACD/IUPAC Name]
[4-Methyl-5,7-bis-(2-methyl-allyloxy)-2-oxo-2H-chromen-3-yl]-acetic acid methyl ester
892559-81-8 [RN]
C21H24O6
methyl {4-methyl-5,7-bis[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetate
methyl 2-(4-methyl-5,7-bis((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetate
methyl 2-[5,7-bis(2-methylprop-2-enyloxy)-4-methyl-2-oxochromen-3-yl]acetate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 512.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 222.7±30.2 °C
Index of Refraction: 1.526
Molar Refractivity: 100.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.29
ACD/LogD (pH 5.5): 4.59
ACD/BCF (pH 5.5): 1830.44
ACD/KOC (pH 5.5): 7532.41
ACD/LogD (pH 7.4): 4.59
ACD/BCF (pH 7.4): 1830.44
ACD/KOC (pH 7.4): 7532.41
Polar Surface Area: 71 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 37.9±3.0 dyne/cm
Molar Volume: 327.5±3.0 cm3

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