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

Glutaric acid, 1,1,1-trifluoroprop-2-yl oct-3-en-2-yl ester

InChI
InChI=1S/C16H25F3O4/c1-4-5-6-7-9-12(2)22-14(20)10-8-11-15(21)23-13(3)16(17,18)19/h7,9,12-13H,4-6,8,10-11H2,1-3H3/b9-7+
InChI Key
PBYLROOOKDHVAP-VQHVLOKHSA-N
Formula
C16H25F3O4
SMILES
CCCC/C=C/C(C)OC(=O)CCCC(=O)OC(C)C(F)(F)F
Molecular Weight1
338.37
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Physical Properties

Property Value Unit Source
ΔfH°gas -1559.33 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 37.75 kJ/mol Joback Calculated Property
ΔvapH° 79.78 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 4.329 Crippen Calculated Property
McVol 252.190 ml/mol McGowan Calculated Property
Inp [1662.00; 1662.00]   Show Hide
Inp 1662.00 NIST
Inp 1662.00 NIST
Tfus 261.07 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, 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 [736.88; 816.62] J/mol×K [715.92; 891.85] Show Hide
Cp,gas 736.88 J/mol×K 715.92 Joback Calculated Property
Cp,gas 752.14 J/mol×K 745.24 Joback Calculated Property
Cp,gas 766.58 J/mol×K 774.56 Joback Calculated Property
Cp,gas 780.22 J/mol×K 803.88 Joback Calculated Property
Cp,gas 793.09 J/mol×K 833.20 Joback Calculated Property
Cp,gas 805.21 J/mol×K 862.52 Joback Calculated Property
Cp,gas 816.62 J/mol×K 891.85 Joback Calculated Property

Similar Compounds

Glutaric acid, dodec-2-en-1-yl 1,1,1-trifluoroprop-2-yl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl undec-2-enyl ester. Glutaric acid, but-3-yn-2-yl oct-3-en-2-yl ester. Glutaric acid, 3-methylbut-2-en-1-yl oct-3-en-2-yl ester. Glutaric acid, hex-2-en-1-yl 1,1,1-trifluoroprop-2-yl ester. Glutaric acid, 2,2,3,3-tetrafluoropropyl oct-3-en-2-yl ester. Hexanoic acid, oct-3-en-2-yl ester. Butanoic acid, oct-3-en-2-yl ester. Glutaric acid, 2,2-dichloroethyl oct-3-en-2-yl ester. Octanoic acid, oct-3-en-2-yl ester. Sebacic acid, di(oct-3-en-2-yl) ester. Glutaric acid, 3-methylbut-2-yl oct-3-en-2-yl ester. Sebacic acid, oct-3-en-2-yl propyl ester. Sebacic acid, isobutyl oct-3-en-2-yl ester. 5-Chlorovaleric acid, oct-3-en-2-yl ester.

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

Sources

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