ChemSpider 2D Image | 5,7-Dimethoxy-4-methyl-3-methylene-2-benzofuran-1(3H)-one | C12H12O4

5,7-Dimethoxy-4-methyl-3-methylene-2-benzofuran-1(3H)-one

  • Molecular FormulaC12H12O4
  • Average mass220.221 Da
  • Monoisotopic mass220.073563 Da
  • ChemSpider ID28524484

More details:

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

1(3H)-Isobenzofuranone, 5,7-dimethoxy-4-methyl-3-methylene- [ACD/Index Name]
5,7-Dimethoxy-4-methyl-3-methylen-2-benzofuran-1(3H)-on [German] [ACD/IUPAC Name]
5,7-Dimethoxy-4-methyl-3-methylene-2-benzofuran-1(3H)-one [ACD/IUPAC Name]
5,7-Diméthoxy-4-méthyl-3-méthylène-2-benzofuran-1(3H)-one [French] [ACD/IUPAC Name]
acremonide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 377.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.5±3.0 kJ/mol
Flash Point: 169.5±27.9 °C
Index of Refraction: 1.553
Molar Refractivity: 57.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 2.66
ACD/BCF (pH 5.5): 61.59
ACD/KOC (pH 5.5): 664.54
ACD/LogD (pH 7.4): 2.66
ACD/BCF (pH 7.4): 61.59
ACD/KOC (pH 7.4): 664.54
Polar Surface Area: 45 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 43.1±5.0 dyne/cm
Molar Volume: 179.1±5.0 cm3

Click to predict properties on the Chemicalize site


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