Chemical Properties of Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-methylphenyl ester

Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-methylphenyl ester

InChI
InChI=1S/C15H17F3O4/c1-10-5-3-6-12(9-10)22-14(20)8-4-7-13(19)21-11(2)15(16,17)18/h3,5-6,9,11H,4,7-8H2,1-2H3
InChI Key
RGPIZBVYDPZCHZ-UHFFFAOYSA-N
Formula
C15H17F3O4
SMILES
Cc1cccc(OC(=O)CCCC(=O)OC(C)C(F)(F)F)c1
Molecular Weight1
318.29
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Physical Properties

Property Value Unit Source
ΔfusH° 35.30 kJ/mol Joback Calculated Property
IE 8.77 eV Relay (1.0) Calculated Property
log10WS -3.69 Relay (1.0) Calculated Property
logPoct/wat 3.565 Crippen Calculated Property
McVol 218.640 ml/mol McGowan Calculated Property
Inp [1746.00; 1746.00]   Show Hide
Inp 1746.00 NIST
Inp 1746.00 NIST
Tboil 570.96 K Relay (1.0) Calculated Property
Tfus 299.31 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 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 [610.22; 681.14] J/mol×K [685.04; 874.78] Show Hide
Cp,gas 610.22 J/mol×K 685.04 Joback Calculated Property
Cp,gas 624.39 J/mol×K 716.66 Joback Calculated Property
Cp,gas 637.58 J/mol×K 748.29 Joback Calculated Property
Cp,gas 649.82 J/mol×K 779.91 Joback Calculated Property
Cp,gas 661.14 J/mol×K 811.54 Joback Calculated Property
Cp,gas 671.58 J/mol×K 843.16 Joback Calculated Property
Cp,gas 681.14 J/mol×K 874.78 Joback Calculated Property

Similar Compounds

Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-methylphenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-ethylphenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-chloro-5-methylphenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2,3-dimethylphenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 5-methyl-2-methoxybenzyl ester. Glutaric acid, but-3-yn-2-yl 3-methylphenyl ester. Glutaric acid, ethyl 3-methylphenyl ester. Glutaric acid, 3-methylphenyl propyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-methyl-4-chlorophenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 4-cyanophenyl ester. Glutaric acid, 3-methylbut-2-yl 3-methylphenyl ester. Glutaric acid, butyl 3-methylphenyl ester. Glutaric acid, 3-methylphenyl pentyl ester. Glutaric acid, isobutyl 3-methylphenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-formylphenyl ester.

Find more compounds similar to Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-methylphenyl ester.

Sources

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