Chemical Properties of Glutaric acid, isobutyl 2,3,4,5-tetrafluorobenzyl ester

Glutaric acid, isobutyl 2,3,4,5-tetrafluorobenzyl ester

InChI
InChI=1S/C16H18F4O4/c1-9(2)7-23-12(21)4-3-5-13(22)24-8-10-6-11(17)15(19)16(20)14(10)18/h6,9H,3-5,7-8H2,1-2H3
InChI Key
GKRCBIDXBYKCKH-UHFFFAOYSA-N
Formula
C16H18F4O4
SMILES
CC(C)COC(=O)CCCC(=O)OCc1cc(F)c(F)c(F)c1F
Molecular Weight1
350.31
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Physical Properties

Property Value Unit Source
ΔfH°gas -1437.44 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 47.22 kJ/mol Joback Calculated Property
ΔvapH° 84.98 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.656 Crippen Calculated Property
McVol 234.500 ml/mol McGowan Calculated Property
Pc 1429.38 kPa Joback Calculated Property
Inp [1990.00; 1990.00]   Show Hide
Inp 1990.00 NIST
Inp 1990.00 NIST
Tboil 580.92 K Relay (1.0) Calculated Property
Tc 754.91 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, 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 [667.09; 735.02] J/mol×K [725.36; 904.83] Show Hide
Cp,gas 667.09 J/mol×K 725.36 Joback Calculated Property
Cp,gas 680.46 J/mol×K 755.27 Joback Calculated Property
Cp,gas 693.01 J/mol×K 785.18 Joback Calculated Property
Cp,gas 704.74 J/mol×K 815.10 Joback Calculated Property
Cp,gas 715.65 J/mol×K 845.01 Joback Calculated Property
Cp,gas 725.74 J/mol×K 874.92 Joback Calculated Property
Cp,gas 735.02 J/mol×K 904.83 Joback Calculated Property

Similar Compounds

Glutaric acid, 2,4,5-trifluorobenzyl isobutyl ester. Glutaric acid, propyl 2,3,4,5-tetrafluorobenzyl ester. Succinic acid, isobutyl 2,3,4,5-tetrafluorobenzyl ester. Glutaric acid, butyl 2,3,4,5-tetrafluorobenzyl ester. Glutaric acid, pentyl 2,3,4,5-tetrafluorobenzyl ester. Glutaric acid, ethyl 2,3,4,5-tetrafluorobenzyl ester. Glutaric acid, isobutyl pentafluorobenzyl ester. Glutaric acid, 2,5-difluorobenzyl isobutyl ester. Glutaric acid, hexyl 2,3,4,5-tetrafluorobenzyl ester. Glutaric acid, isobutyl 2,3,6-trifluorobenzyl ester. Glutaric acid, heptyl 2,3,4,5-tetrafluorobenzyl ester. Glutaric acid, octadecyl 2,3,4,5-tetrafluorobenzyl ester. Glutaric acid, 2,3,4,5-tetrafluorobenzyl tridecyl ester. Glutaric acid, heptadecyl 2,3,4,5-tetrafluorobenzyl ester. Glutaric acid, 2,3,4,5-tetrafluorobenzyl undecyl ester.

Find more compounds similar to Glutaric acid, isobutyl 2,3,4,5-tetrafluorobenzyl ester.

Sources

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