Chemical Properties of Sebacic acid, di(1-phenyl-2,2,2-trifluoromethylethyl) ester

Sebacic acid, di(1-phenyl-2,2,2-trifluoromethylethyl) ester

InChI
InChI=1S/C26H28F6O4/c27-25(28,29)23(19-13-7-5-8-14-19)35-21(33)17-11-3-1-2-4-12-18-22(34)36-24(26(30,31)32)20-15-9-6-10-16-20/h5-10,13-16,23-24H,1-4,11-12,17-18H2
InChI Key
PIMLFEBSXKKYCL-UHFFFAOYSA-N
Formula
C26H28F6O4
SMILES
O=C(CCCCCCCCC(=O)OC(c1ccccc1)C(F)(F)F)OC(c1ccccc1)C(F)(F)F
Molecular Weight1
518.49
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Physical Properties

Property Value Unit Source
ΔfusH° 56.52 kJ/mol Joback Calculated Property
logPoct/wat 7.801 Crippen Calculated Property
McVol 355.180 ml/mol McGowan Calculated Property
Inp [2547.00; 2547.00]   Show Hide
Inp 2547.00 NIST
Inp 2547.00 NIST
Tboil 668.19 K Relay (1.0) Calculated Property

Cheméo can also estimate 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, 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 [1168.56; 1233.26] J/mol×K [952.56; 1166.40] Show Hide
Cp,gas 1168.56 J/mol×K 952.56 Joback Calculated Property
Cp,gas 1182.10 J/mol×K 988.20 Joback Calculated Property
Cp,gas 1194.39 J/mol×K 1023.84 Joback Calculated Property
Cp,gas 1205.53 J/mol×K 1059.48 Joback Calculated Property
Cp,gas 1215.66 J/mol×K 1095.12 Joback Calculated Property
Cp,gas 1224.86 J/mol×K 1130.76 Joback Calculated Property
Cp,gas 1233.26 J/mol×K 1166.40 Joback Calculated Property

Similar Compounds

Glutaric acid, di(1-phenyl-2,2,2-trifluoroethyl) ester. Sebacic acid, 1-phenyl-2,2,2-trifluoromethylethyl propyl ester. Glutaric acid, ethyl 1-phenyl-2,2,2-trifluoroethyl ester. Sebacic acid, butyl 1-phenyl-2,2,2-trifluoromethylethyl ester. Sebacic acid, isobutyl 1-phenyl-2,2,2-trifluoromethylethyl ester. Sebacic acid, 1-phenyl-2,2,2-trifluoromethylethyl dodecyl ester. Sebacic acid, heptyl 1-phenyl-2,2,2-trifluoromethylethyl ester. Sebacic acid, octyl 1-phenyl-2,2,2-trifluoromethylethyl ester. Sebacic acid, decyl 1-phenyl-2,2,2-trifluoromethylethyl ester. Sebacic acid, pentyl 1-phenyl-2,2,2-trifluoromethylethyl ester. Sebacic acid, undecyl 1-phenyl-2,2,2-trifluoromethylethyl ester. Sebacic acid, hexyl 1-phenyl-2,2,2-trifluoromethylethyl ester. Sebacic acid, 1-phenyl-2,2,2-trifluoromethylethyl tridecyl ester. Sebacic acid, 1-phenyl-2,2,2-trifluoromethylethyl tetradecyl ester. Sebacic acid, hexadecyl 1-phenyl-2,2,2-trifluoromethylethyl ester.

Find more compounds similar to Sebacic acid, di(1-phenyl-2,2,2-trifluoromethylethyl) ester.

Sources

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