ChemSpider 2D Image | Tetraethyl 2,5-dioxooctahydro-1,3,4,6-pentalenetetracarboxylate | C20H26O10

Tetraethyl 2,5-dioxooctahydro-1,3,4,6-pentalenetetracarboxylate

  • Molecular FormulaC20H26O10
  • Average mass426.414 Da
  • Monoisotopic mass426.152588 Da
  • ChemSpider ID46135592

  • defined stereocentres - 2 of 6 defined stereocentres

More details:

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

1,3,4,6-Pentalenetetracarboxylic acid, octahydro-2,5-dioxo-, tetraethyl ester [ACD/Index Name]
2,5-Dioxooctahydro-1,3,4,6-pentalènetétracarboxylate de tétraéthyle [French] [ACD/IUPAC Name]
Tetraethyl 2,5-dioxooctahydro-1,3,4,6-pentalenetetracarboxylate [ACD/IUPAC Name]
Tetraethyl-2,5-dioxooctahydro-1,3,4,6-pentalentetracarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 541.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.0±3.0 kJ/mol
Flash Point: 234.5±30.2 °C
Index of Refraction: 1.499
Molar Refractivity: 97.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 2.12
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 14.29
ACD/KOC (pH 5.5): 232.88
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 8.09
ACD/KOC (pH 7.4): 131.82
Polar Surface Area: 139 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 47.4±3.0 dyne/cm
Molar Volume: 332.4±3.0 cm3

Click to predict properties on the Chemicalize site


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