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

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [380.65; 784.71] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A8.87520e+01
Coefficient B1.22366e+00
Coefficient C-5.80000e-04
Coefficient D5.23000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 380.65 J/mol×K 273.00 Calculated Property
Cp,gas 451.38 J/mol×K 353.78 Calculated Property
Cp,gas 515.27 J/mol×K 434.56 Calculated Property
Cp,gas 572.47 J/mol×K 515.33 Calculated Property
Cp,gas 623.17 J/mol×K 596.11 Calculated Property
Cp,gas 667.51 J/mol×K 676.89 Calculated Property
Cp,gas 705.67 J/mol×K 757.67 Calculated Property
Cp,gas 737.82 J/mol×K 838.44 Calculated Property
Cp,gas 764.11 J/mol×K 919.22 Calculated Property
Cp,gas 784.71 J/mol×K 1000.00 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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