Chemical Properties of Succinic acid, ethyl 4-trifluoromethoxybenzyl ester

Succinic acid, ethyl 4-trifluoromethoxybenzyl ester

InChI
InChI=1S/C14H15F3O5/c1-2-20-12(18)7-8-13(19)21-9-10-3-5-11(6-4-10)22-14(15,16)17/h3-6H,2,7-9H2,1H3
InChI Key
KKEJXQUCMJRKBV-UHFFFAOYSA-N
Formula
C14H15F3O5
SMILES
CCOC(=O)CCC(=O)OCc1ccc(OC(F)(F)F)cc1
Molecular Weight1
320.26
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Physical Properties

Property Value Unit Source
ΔfusH° 37.42 kJ/mol Joback Calculated Property
log10WS -3.81 Relay (1.0) Calculated Property
logPoct/wat 2.972 Crippen Calculated Property
McVol 210.420 ml/mol McGowan Calculated Property
Pc 1781.84 kPa Joback Calculated Property
Inp [1747.00; 1747.00]   Show Hide
Inp 1747.00 NIST
Inp 1747.00 NIST
Tboil 563.55 K Relay (1.0) Calculated Property
Tc 719.54 K Relay (1.0) Calculated Property
Tfus 271.67 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [318.98; 677.43] 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 A4.06740e+01
Coefficient B1.18382e+00
Coefficient C-6.22760e-04
Coefficient D7.57000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 318.98 J/mol×K 273.00 Calculated Property
Cp,gas 384.89 J/mol×K 353.78 Calculated Property
Cp,gas 443.72 J/mol×K 434.56 Calculated Property
Cp,gas 495.71 J/mol×K 515.33 Calculated Property
Cp,gas 541.10 J/mol×K 596.11 Calculated Property
Cp,gas 580.13 J/mol×K 676.89 Calculated Property
Cp,gas 613.04 J/mol×K 757.67 Calculated Property
Cp,gas 640.07 J/mol×K 838.44 Calculated Property
Cp,gas 661.45 J/mol×K 919.22 Calculated Property
Cp,gas 677.43 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, di(4-trifluoromethoxybenzyl) ester. Glutaric acid, ethyl 4-(trifluoromethoxy)benzyl ester. Succinic acid, butyl 4-trifluoromethoxybenzyl ester. Succinic acid, isobutyl 4-trifluoromethoxybenzyl ester. Succinic acid, di(4-methoxybenzyl) ester. Succinic acid, pentyl 4-trifluoromethoxybenzyl ester. Glutaric acid, di(4-(trifluoromethoxy)benzyl) ester. Succinic acid, hexyl 4-trifluoromethoxybenzyl ester. Glutaric acid, propyl 4-(trifluoromethoxy)benzyl ester. Glutaric acid, butyl 4-(trifluoromethoxy)benzyl ester. Sebacic acid, di(4-trifluoromethoxybenzyl) ester. Sebacic acid, propyl 4-trifluoromethoxybenzyl ester. Sebacic acid, butyl 4-trifluoromethoxybenzyl ester. Sebacic acid, ethyl 4-methoxybenzyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 4-methoxybenzyl ester.

Find more compounds similar to Succinic acid, ethyl 4-trifluoromethoxybenzyl ester.

Sources

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