Chemical Properties of Fumaric acid, 3-methylbutyl 2,2,3,3,4,4,5,5-octafluoropentyl ester

Fumaric acid, 3-methylbutyl 2,2,3,3,4,4,5,5-octafluoropentyl ester

InChI
InChI=1S/C14H16F8O4/c1-8(2)5-6-25-9(23)3-4-10(24)26-7-12(17,18)14(21,22)13(19,20)11(15)16/h3-4,8,11H,5-7H2,1-2H3/b4-3+
InChI Key
IVRZADLFRIWRDA-ONEGZZNKSA-N
Formula
C14H16F8O4
SMILES
CC(C)CCOC(=O)C=CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F
Molecular Weight1
400.26
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Physical Properties

Property Value Unit Source
Δfgas -2440.24 kJ/mol Relay (1.0) Calculated Property
Δfus 33.14 kJ/mol Joback Calculated Property
Δvap 79.28 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.846 Crippen Calculated Property
McVol 232.860 ml/mol McGowan Calculated Property
Inp [1548.00; 1548.00]   Show Hide
Inp 1548.00 NIST
Inp 1548.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [672.85; 739.09] J/mol×K [660.05; 822.71] Show Hide
Cp,gas 672.85 J/mol×K 660.05 Joback Calculated Property
Cp,gas 685.69 J/mol×K 687.16 Joback Calculated Property
Cp,gas 697.75 J/mol×K 714.27 Joback Calculated Property
Cp,gas 709.09 J/mol×K 741.38 Joback Calculated Property
Cp,gas 719.72 J/mol×K 768.49 Joback Calculated Property
Cp,gas 729.71 J/mol×K 795.60 Joback Calculated Property
Cp,gas 739.09 J/mol×K 822.71 Joback Calculated Property

Similar Compounds

Fumaric acid, isohexyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, butyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, 2-ethylbutyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, 3-(2-methoxyethyl)heptyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentyl ester. Fumaric acid, 2-methylpentyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, hexyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, heptyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl tridecyl ester. Fumaric acid, nonadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, dodecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, nonyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, heptadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl tetradecyl ester. Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl octyl ester.

Find more compounds similar to Fumaric acid, 3-methylbutyl 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Sources

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