ChemSpider 2D Image | Ethyl 5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-2-oxo-3-(3,4,5-trimethoxybenzyl)tetrahydro-3-furancarboxylate | C26H28O10

Ethyl 5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-2-oxo-3-(3,4,5-trimethoxybenzyl)tetrahydro-3-furancarboxylate

  • Molecular FormulaC26H28O10
  • Average mass500.495 Da
  • Monoisotopic mass500.168243 Da
  • ChemSpider ID310105

More details:

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

3-Furancarboxylic acid, 5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]tetrahydro-2-oxo-3-[(3,4,5-trimethoxyphenyl)methyl]-, ethyl ester [ACD/Index Name]
5-[2-(1,3-Benzodioxol-5-yl)-2-oxoéthyl]-2-oxo-3-(3,4,5-triméthoxybenzyl)tétrahydro-3-furanecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-2-oxo-3-(3,4,5-trimethoxybenzyl)tetrahydro-3-furancarboxylate [ACD/IUPAC Name]
Ethyl-5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-2-oxo-3-(3,4,5-trimethoxybenzyl)tetrahydro-3-furancarboxylat [German] [ACD/IUPAC Name]

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

NSC408983 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 664.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.7±3.0 kJ/mol
Flash Point: 283.1±31.5 °C
Index of Refraction: 1.561
Molar Refractivity: 125.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 34.89
ACD/KOC (pH 5.5): 442.49
ACD/LogD (pH 7.4): 2.33
ACD/BCF (pH 7.4): 34.89
ACD/KOC (pH 7.4): 442.49
Polar Surface Area: 116 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 48.6±3.0 dyne/cm
Molar Volume: 387.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement