Chemical Properties of 4-(Trifluoromethyl)benzoic acid, tridec-2-ynyl ester

4-(Trifluoromethyl)benzoic acid, tridec-2-ynyl ester

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InChI
InChI=1S/C21H27F3O2/c1-2-3-4-5-6-7-8-9-10-11-12-17-26-20(25)18-13-15-19(16-14-18)21(22,23)24/h13-16H,2-10,17H2,1H3
InChI Key
PWXIZEZTCINYQG-UHFFFAOYSA-N
Formula
C21H27F3O2
SMILES
CCCCCCCCCCC#CCOC(=O)c1ccc(C(F)(F)F)cc1
Molecular Weight1
368.43
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Physical Properties

Property Value Unit Source
Δf -383.99 kJ/mol Joback Calculated Property
Δfgas -821.29 kJ/mol Joback Calculated Property
Δfus 51.53 kJ/mol Joback Calculated Property
Δvap 72.84 kJ/mol Joback Calculated Property
log10WS -7.64 Crippen Calculated Property
logPoct/wat 6.396 Crippen Calculated Property
McVol 287.140 ml/mol McGowan Calculated Property
Pc 1250.38 kPa Joback Calculated Property
Inp 2220.00 NIST
Tboil 791.41 K Joback Calculated Property
Tc 986.06 K Joback Calculated Property
Tfus 547.82 K Joback Calculated Property
Vc 1.133 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [860.49; 945.36] J/mol×K [791.41; 986.06] Show Hide
Cp,gas 860.49 J/mol×K 791.41 Joback Calculated Property
Cp,gas 877.00 J/mol×K 823.85 Joback Calculated Property
Cp,gas 892.50 J/mol×K 856.29 Joback Calculated Property
Cp,gas 907.03 J/mol×K 888.74 Joback Calculated Property
Cp,gas 920.65 J/mol×K 921.18 Joback Calculated Property
Cp,gas 933.41 J/mol×K 953.62 Joback Calculated Property
Cp,gas 945.36 J/mol×K 986.06 Joback Calculated Property

Similar Compounds

3-Trifluoromethylbenzoic acid, tridec-2-ynyl ester. 4-Cyanobenzoic acid, tridec-2-ynyl ester. p-Toluic acid, tridec-2-ynyl ester. 4-Fluorobenzoic acid, tridec-2-ynyl ester. 2-Trifluoromethylbenzoic acid, tridec-2-ynyl ester. 4-Bromobenzoic acid, tridec-2-ynyl ester. 4-Chlorobenzoic acid, tridec-2-ynyl ester. Isophthalic acid, ethyl tridec-2-ynyl ester. 4-Nitrobenzoic acid, tridec-2-ynyl ester. 3-Fluorobenzoic acid, tridec-2-ynyl ester. 3-Bromobenzoic acid, tridec-2-ynyl ester. m-Toluic acid, tridec-2-ynyl ester. p-Anisic acid, tridec-2-ynyl ester. 1-Naphthoic acid, tridec-2-ynyl ester. Isophthalic acid, isobutyl tridec-2-ynyl ester.

Find more compounds similar to 4-(Trifluoromethyl)benzoic acid, tridec-2-ynyl ester.

Sources

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