Chemical Properties of Succinic acid, isobutyl 4-trifluoromethoxybenzyl ester

Succinic acid, isobutyl 4-trifluoromethoxybenzyl ester

InChI
InChI=1S/C16H19F3O5/c1-11(2)9-22-14(20)7-8-15(21)23-10-12-3-5-13(6-4-12)24-16(17,18)19/h3-6,11H,7-10H2,1-2H3
InChI Key
NMYJFJVMHQIMRX-UHFFFAOYSA-N
Formula
C16H19F3O5
SMILES
CC(C)COC(=O)CCC(=O)OCc1ccc(OC(F)(F)F)cc1
Molecular Weight1
348.31
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Physical Properties

Property Value Unit Source
ΔfH°gas -1564.64 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 39.08 kJ/mol Joback Calculated Property
ΔvapH° 82.09 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.608 Crippen Calculated Property
McVol 238.600 ml/mol McGowan Calculated Property
Pc 1534.26 kPa Joback Calculated Property
Inp [1873.00; 1873.00]   Show Hide
Inp 1873.00 NIST
Inp 1873.00 NIST
Tboil 583.94 K Relay (1.0) Calculated Property
Tc 735.54 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 [691.50; 761.37] J/mol×K [730.34; 918.75] Show Hide
Cp,gas 691.50 J/mol×K 730.34 Joback Calculated Property
Cp,gas 705.59 J/mol×K 761.74 Joback Calculated Property
Cp,gas 718.68 J/mol×K 793.14 Joback Calculated Property
Cp,gas 730.78 J/mol×K 824.54 Joback Calculated Property
Cp,gas 741.92 J/mol×K 855.94 Joback Calculated Property
Cp,gas 752.11 J/mol×K 887.34 Joback Calculated Property
Cp,gas 761.37 J/mol×K 918.75 Joback Calculated Property

Similar Compounds

Glutaric acid, isobutyl 4-(trifluoromethoxy)benzyl ester. Sebacic acid, isobutyl 4-trifluoromethoxybenzyl ester. Succinic acid, butyl 4-trifluoromethoxybenzyl ester. Succinic acid, ethyl 4-trifluoromethoxybenzyl ester. Succinic acid, pentyl 4-trifluoromethoxybenzyl ester. Succinic acid, isobutyl 4-phenoxybenzyl ester. Glutaric acid, isobutyl 4-methoxybenzyl ester. Succinic acid, hexyl 4-trifluoromethoxybenzyl ester. Sebacic acid, isobutyl 4-methoxybenzyl ester. Glutaric acid, propyl 4-(trifluoromethoxy)benzyl ester. Pimelic acid, isobutyl 4-methoxybenzyl ester. Sebacic acid, propyl 4-trifluoromethoxybenzyl ester. Glutaric acid, butyl 4-(trifluoromethoxy)benzyl ester. Sebacic acid, butyl 4-trifluoromethoxybenzyl ester. Sebacic acid, hexyl 4-trifluoromethoxybenzyl ester.

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

Sources

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