Chemical Properties of 4-(Trifluoromethyl)benzoic acid, oct-3-en-2-yl ester

4-(Trifluoromethyl)benzoic acid, oct-3-en-2-yl ester

InChI
InChI=1S/C16H19F3O2/c1-3-4-5-6-7-12(2)21-15(20)13-8-10-14(11-9-13)16(17,18)19/h6-12H,3-5H2,1-2H3/b7-6+
InChI Key
LAJBFUMGBXUHPT-VOTSOKGWSA-N
Formula
C16H19F3O2
SMILES
CCCC/C=C/C(C)OC(=O)c1ccc(C(F)(F)F)cc1
Molecular Weight1
300.32
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Physical Properties

Property Value Unit Source
ΔfusH° 33.72 kJ/mol Joback Calculated Property
logPoct/wat 4.997 Crippen Calculated Property
McVol 220.990 ml/mol McGowan Calculated Property
Inp 1621.00 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, 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 [598.82; 678.92] J/mol×K [653.86; 844.33] Show Hide
Cp,gas 598.82 J/mol×K 653.86 Joback Calculated Property
Cp,gas 614.49 J/mol×K 685.61 Joback Calculated Property
Cp,gas 629.16 J/mol×K 717.35 Joback Calculated Property
Cp,gas 642.89 J/mol×K 749.10 Joback Calculated Property
Cp,gas 655.73 J/mol×K 780.84 Joback Calculated Property
Cp,gas 667.72 J/mol×K 812.59 Joback Calculated Property
Cp,gas 678.92 J/mol×K 844.33 Joback Calculated Property

Similar Compounds

4-Cyanobenzoic acid, oct-3-en-2-yl ester. 3-Trifluoromethylbenzoic acid, oct-3-en-2-yl ester. p-Toluic acid, oct-3-en-2-yl ester. 4-Fluorobenzoic acid. oct-3-en-2-yl ester. 4-Bromobenzoic acid, oct-3-en-2-yl ester. Isophthalic acid, di(oct-3-en-2-yl) ester. 4-Chlorobenzoic acid, oct-3-en-2-yl ester. 2-Trifluoromethylbenzoic acid, oct-3-en-2-yl ester. 3-Fluorobenzoic acid, oct-3-en-2-yl ester. 4-(Trifluoromethyl)benzoic acid, undec-2-enyl ester. 3-Bromobenzoic acid, oct-3-en-2-yl ester. p-Anisic acid, oct-3-en-2-yl ester. 2-Fluorobenzoic acid, oct-3-en-2-yl ester. 1-Naphthoic acid, oct-3-en-2-yl ester. 2-Bromobenzoic acid, oct-3-en-2-yl ester.

Find more compounds similar to 4-(Trifluoromethyl)benzoic acid, oct-3-en-2-yl ester.

Sources

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