ChemSpider 2D Image | 7,7a-Dimethyl-3-(2-methyl-2-propanyl)-2,5-dioxo-2,3,3a,4,5,7a-hexahydro-1-benzofuran-3-carboxylate | C15H19O5

7,7a-Dimethyl-3-(2-methyl-2-propanyl)-2,5-dioxo-2,3,3a,4,5,7a-hexahydro-1-benzofuran-3-carboxylate

  • Molecular FormulaC15H19O5
  • Average mass279.309 Da
  • Monoisotopic mass279.123810 Da
  • ChemSpider ID26998442

  • Charge - Charge

More details:

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

3-Benzofurancarboxylic acid, 3-(1,1-dimethylethyl)-2,3,3a,4,5,7a-hexahydro-7,7a-dimethyl-2,5-dioxo-, ion(1-) [ACD/Index Name]
7,7a-Dimethyl-3-(2-methyl-2-propanyl)-2,5-dioxo-2,3,3a,4,5,7a-hexahydro-1-benzofuran-3-carboxylat [German] [ACD/IUPAC Name]
7,7a-Dimethyl-3-(2-methyl-2-propanyl)-2,5-dioxo-2,3,3a,4,5,7a-hexahydro-1-benzofuran-3-carboxylate [ACD/IUPAC Name]
7,7a-Diméthyl-3-(2-méthyl-2-propanyl)-2,5-dioxo-2,3,3a,4,5,7a-hexahydro-1-benzofurane-3-carboxylate [French] [ACD/IUPAC Name]
tert-Butyl-7,7a-dimethyl-2,5-dioxo-2,3,3a,4,5,7a-hexahydrobenzofuran-3-carboxylate

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

Density:
Boiling Point: 472.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 80.6±6.0 kJ/mol
Flash Point: 175.5±22.2 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.53
ACD/LogD (pH 5.5): -1.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement