Chemical Properties of Fumaric acid, pentafluorobenzyl 2-methylpent-3-yl ester

Fumaric acid, pentafluorobenzyl 2-methylpent-3-yl ester

InChI
InChI=1S/C17H17F5O4/c1-4-10(8(2)3)26-12(24)6-5-11(23)25-7-9-13(18)15(20)17(22)16(21)14(9)19/h5-6,8,10H,4,7H2,1-3H3/b6-5+
InChI Key
KIFJHVPUFQAYHM-AATRIKPKSA-N
Formula
C17H17F5O4
SMILES
CCC(OC(=O)C=CC(=O)OCc1c(F)c(F)c(F)c(F)c1F)C(C)C
Molecular Weight1
380.31
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Physical Properties

Property Value Unit Source
ΔfusH° 49.18 kJ/mol Joback Calculated Property
logPoct/wat 3.959 Crippen Calculated Property
McVol 246.060 ml/mol McGowan Calculated Property
Inp [1925.00; 1925.00]   Show Hide
Inp 1925.00 NIST
Inp 1925.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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 [705.04; 769.62] J/mol×K [756.21; 938.80] Show Hide
Cp,gas 705.04 J/mol×K 756.21 Joback Calculated Property
Cp,gas 717.89 J/mol×K 786.64 Joback Calculated Property
Cp,gas 729.89 J/mol×K 817.07 Joback Calculated Property
Cp,gas 741.05 J/mol×K 847.51 Joback Calculated Property
Cp,gas 751.39 J/mol×K 877.94 Joback Calculated Property
Cp,gas 760.91 J/mol×K 908.37 Joback Calculated Property
Cp,gas 769.62 J/mol×K 938.80 Joback Calculated Property

Similar Compounds

Fumaric acid, pentafluorobenzyl 3-methylbut-2-yl ester. Fumaric acid, pentafluorobenzyl hept-2-yl ester. Succinic acid, 2-methylpent-3-yl pentafluorobenzyl ester. Glutaric acid, 2-methylpent-3-yl pentafluorobenzyl ester. Succinic acid, 2-methylhex-3-yl 2,3,4,5-tetrafluorobenzyl ester. Glutaric acid, 2-methylhex-3-yl 2,3,4,5-tetrafluorobenzyl ester. Succinic acid, 3-methylbut-2-yl pentafluorobenzyl ester. Glutaric acid, 3-methylbut-2-yl pentafluorobenzyl ester. Glutaric acid, 2-methylhex-3-yl 2,3,6-trifluorobenzyl ester. Pimelic acid, 4-methyl-2-pentyl pentafluorobenzyl ester. Glutaric acid, 2,4,5-trifluorobenzyl 2-methylhex-3-yl ester. Fumaric acid, 4-chlorobenzyl 2-methylpent-3-yl ester. Succinic acid, 2-methylhex-3-yl 2,3,6-trifluorobenzyl ester. Succinic acid, 2-methylhex-3-yl 2,4,5-trifluorobenzyl ester. Glutaric acid, 2-methylhex-3-yl 1-(pentafluorophenyl)ethyl ester.

Find more compounds similar to Fumaric acid, pentafluorobenzyl 2-methylpent-3-yl ester.

Sources

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