Chemical Properties of Glutaric acid, 2,2,3,3-tetrafluoropropyl 4-methoxybenzyl ester

Glutaric acid, 2,2,3,3-tetrafluoropropyl 4-methoxybenzyl ester

InChI
InChI=1S/C16H18F4O5/c1-23-12-7-5-11(6-8-12)9-24-13(21)3-2-4-14(22)25-10-16(19,20)15(17)18/h5-8,15H,2-4,9-10H2,1H3
InChI Key
MRKNHBAJYXSXFS-UHFFFAOYSA-N
Formula
C16H18F4O5
SMILES
COc1ccc(COC(=O)CCCC(=O)OCC(F)(F)C(F)F)cc1
Molecular Weight1
366.30
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Physical Properties

Property Value Unit Source
ΔfusH° 42.16 kJ/mol Joback Calculated Property
IE 8.70 eV Relay (1.0) Calculated Property
logPoct/wat 3.352 Crippen Calculated Property
McVol 240.370 ml/mol McGowan Calculated Property
Inp [2096.00; 2096.00]   Show Hide
Inp 2096.00 NIST
Inp 2096.00 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, 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [369.29; 788.23] 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 A4.32650e+01
Coefficient B1.39152e+00
Coefficient C-7.51160e-04
Coefficient D1.04600e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 369.29 J/mol×K 273.00 Calculated Property
Cp,gas 446.17 J/mol×K 353.78 Calculated Property
Cp,gas 514.69 J/mol×K 434.56 Calculated Property
Cp,gas 575.19 J/mol×K 515.33 Calculated Property
Cp,gas 628.00 J/mol×K 596.11 Calculated Property
Cp,gas 673.44 J/mol×K 676.89 Calculated Property
Cp,gas 711.86 J/mol×K 757.67 Calculated Property
Cp,gas 743.57 J/mol×K 838.44 Calculated Property
Cp,gas 768.92 J/mol×K 919.22 Calculated Property
Cp,gas 788.23 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, 2,2,3,3-tetrafluoropropyl 4-methoxybenzyl ester. Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 4-methoxybenzyl ester. Glutaric acid, 2,2,3,3-tetrafluoropropyl 4-chlorobenzyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 4-methoxybenzyl ester. Glutaric acid, 2,2,3,3-tetrafluoropropyl 3-phenoxybenzyl ester. Glutaric acid, butyl 4-methoxybenzyl ester. Glutaric acid, hexyl 4-methoxybenzyl ester. Glutaric acid, isobutyl 4-methoxybenzyl ester. Glutaric acid, 2,2,3,3-tetrafluoropropyl (2-naphthyl)methyl ester. Pimelic acid, 4-methoxybenzyl propyl ester. Pimelic acid, hexyl 4-methoxybenzyl ester. Pimelic acid, 4-methoxybenzyl pentyl ester. Sebacic acid, 4-methoxybenzyl propyl ester. Pimelic acid, heptyl 4-methoxybenzyl ester. Sebacic acid, heptyl 4-methoxybenzyl ester.

Find more compounds similar to Glutaric acid, 2,2,3,3-tetrafluoropropyl 4-methoxybenzyl ester.

Sources

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