Chemical Properties of 4-Fluoro-2-trifluoromethylbenzoic acid, pentafluorobenzyl ester

4-Fluoro-2-trifluoromethylbenzoic acid, pentafluorobenzyl ester

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InChI
InChI=1S/C15H5F9O2/c16-5-1-2-6(8(3-5)15(22,23)24)14(25)26-4-7-9(17)11(19)13(21)12(20)10(7)18/h1-3H,4H2
InChI Key
RSJSQKFCISSOOD-UHFFFAOYSA-N
Formula
C15H5F9O2
SMILES
O=C(OCc1c(F)c(F)c(F)c(F)c1F)c1ccc(F)cc1C(F)(F)F
Molecular Weight1
388.18
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Physical Properties

Property Value Unit Source
Δf -1751.54 kJ/mol Joback Calculated Property
Δfgas -1978.70 kJ/mol Joback Calculated Property
Δfus 43.06 kJ/mol Joback Calculated Property
Δvap 58.68 kJ/mol Joback Calculated Property
log10WS -6.92 Crippen Calculated Property
logPoct/wat 4.897 Crippen Calculated Property
McVol 198.060 ml/mol McGowan Calculated Property
Pc 1678.28 kPa Joback Calculated Property
Inp [1593.00; 1593.00]   Show Hide
Inp 1593.00 NIST
Inp 1593.00 NIST
Tboil 697.31 K Joback Calculated Property
Tc 877.52 K Joback Calculated Property
Tfus 479.18 K Joback Calculated Property
Vc 0.835 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [533.92; 584.58] J/mol×K [697.31; 877.52] Show Hide
Cp,gas 533.92 J/mol×K 697.31 Joback Calculated Property
Cp,gas 543.89 J/mol×K 727.35 Joback Calculated Property
Cp,gas 553.23 J/mol×K 757.38 Joback Calculated Property
Cp,gas 561.95 J/mol×K 787.42 Joback Calculated Property
Cp,gas 570.07 J/mol×K 817.45 Joback Calculated Property
Cp,gas 577.61 J/mol×K 847.49 Joback Calculated Property
Cp,gas 584.58 J/mol×K 877.52 Joback Calculated Property

Similar Compounds

2,5-Di(trifluoromethyl)benzoic acid, pentafluorobenzyl ester. 6-Fluoro-2-trifluoromethylbenzoic acid, pentafluorobenzyl ester. 6-Fluoro-3-trifluoromethylbenzoic acid, pentafluorobenzyl ester. Terephthalic acid, di(2-fluoro-6-(trifluoromethyl)benzyl) ester. Phthalic acid, di(2,3,4,5-tetrafluorobenzyl) ester. Phthalic acid, ethyl 2,3,4,5-tetrafluorobenzyl ester. Phthalic acid, di(2,4,5-trifluorobenzyl) ester. Phthalic acid, ethyl 2,4,5-trifluorobenzyl ester. Phthalic acid, di(2,3,6-trifluorobenzyl) ester. 4-(Methylthio)benzoic acid, 2-fluoro-6-(trifluoromethyl)benzyl ester. Phthalic acid, isobutyl 2,3,6-trifluorobenzyl ester. Phthalic acid, propyl 2,3,4,5-tetrafluorobenzyl ester. Phthalic acid, isobutyl 2,3,4,5-tetrafluorobenzyl ester. Terephthalic acid, 2-fluoro-6-(trifluoromethyl)benzyl isobutyl ester. Phthalic acid, butyl 2,3,6-trifluorobenzyl ester.

Find more compounds similar to 4-Fluoro-2-trifluoromethylbenzoic acid, pentafluorobenzyl ester.

Sources

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