Chemical Properties of 4-Fluoro-2-trifluoromethylbenzoic acid, 2,2,3,3,4,4,4-heptafluorobutyl ester

4-Fluoro-2-trifluoromethylbenzoic acid, 2,2,3,3,4,4,4-heptafluorobutyl ester

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InChI
InChI=1S/C12H5F11O2/c13-5-1-2-6(7(3-5)10(16,17)18)8(24)25-4-9(14,15)11(19,20)12(21,22)23/h1-3H,4H2
InChI Key
HWCONUZXSAGTHB-UHFFFAOYSA-N
Formula
C12H5F11O2
SMILES
O=C(OCC(F)(F)C(F)(F)C(F)(F)F)c1ccc(F)cc1C(F)(F)F
Molecular Weight1
390.15
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Physical Properties

Property Value Unit Source
Δf -2222.16 kJ/mol Joback Calculated Property
Δfgas -2514.43 kJ/mol Joback Calculated Property
Δfus 27.11 kJ/mol Joback Calculated Property
Δvap 40.89 kJ/mol Joback Calculated Property
log10WS -5.70 Crippen Calculated Property
logPoct/wat 4.834 Crippen Calculated Property
McVol 183.090 ml/mol McGowan Calculated Property
Pc 1676.91 kPa Joback Calculated Property
Inp [1098.00; 1098.00]   Show Hide
Inp 1098.00 NIST
Inp 1098.00 NIST
Tboil 565.94 K Joback Calculated Property
Tc 725.76 K Joback Calculated Property
Tfus 364.79 K Joback Calculated Property
Vc 0.777 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [496.91; 552.67] J/mol×K [565.94; 725.76] Show Hide
Cp,gas 496.91 J/mol×K 565.94 Joback Calculated Property
Cp,gas 508.07 J/mol×K 592.58 Joback Calculated Property
Cp,gas 518.41 J/mol×K 619.21 Joback Calculated Property
Cp,gas 528.00 J/mol×K 645.85 Joback Calculated Property
Cp,gas 536.88 J/mol×K 672.49 Joback Calculated Property
Cp,gas 545.08 J/mol×K 699.12 Joback Calculated Property
Cp,gas 552.67 J/mol×K 725.76 Joback Calculated Property

Similar Compounds

6-Fluoro-2-trifluoromethylbenzoic acid, 2,2,3,3,4,4,4-heptafluorobutyl ester. 2-Trifluoromethylbenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 6-Fluoro-3-trifluoromethylbenzoic acid, 2,2,3,3,4,4,4-heptafluorobutyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2,2,3,3,4,4,4-heptafluorobutyl ester. Phthalic acid, ethyl 2,2,3,3,4,4,4-heptafluorobutyl ester. Phthalic acid, di(2,2,3,3,4,4,4-heptafluorobutyl) ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, neopentyl ester. Phthalic acid, 2,2,3,3,4,4,4-heptafluorobutyl propyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, propyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, pentyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, hexyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 2-methylbutyl ester. 1,5-Pentanediol, O,O'-di(4-fluoro-2-trifluoromethylbenzoyl)-. 4-Fluoro-2-trifluoromethylbenzoic acid, 6-chlorohexyl ester.

Find more compounds similar to 4-Fluoro-2-trifluoromethylbenzoic acid, 2,2,3,3,4,4,4-heptafluorobutyl ester.

Sources

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