Chemical Properties of 2,3,6-Trifluorobenzoic acid (CAS 2358-29-4)

2,3,6-Trifluorobenzoic acid

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InChI
InChI=1S/C7H3F3O2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2H,(H,11,12)
InChI Key
MGUPHQGQNHDGNK-UHFFFAOYSA-N
Formula
C7H3F3O2
SMILES
O=C(O)c1c(F)ccc(F)c1F
Molecular Weight1
176.09
CAS
2358-29-4
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Physical Properties

Property Value Unit Source
Δf -758.59 kJ/mol Joback Calculated Property
Δfgas -838.83 kJ/mol Joback Calculated Property
Δfus 21.69 kJ/mol Joback Calculated Property
Δvap 56.41 kJ/mol Joback Calculated Property
log10WS -2.53 Crippen Calculated Property
logPoct/wat 1.802 Crippen Calculated Property
McVol 98.480 ml/mol McGowan Calculated Property
Pc 3985.56 kPa Joback Calculated Property
Tboil 545.04 K Joback Calculated Property
Tc 729.27 K Joback Calculated Property
Tfus 345.15 K Joback Calculated Property
Vc 0.399 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [216.12; 250.46] J/mol×K [545.04; 729.27] Show Hide
Cp,gas 216.12 J/mol×K 545.04 Joback Calculated Property
Cp,gas 222.66 J/mol×K 575.75 Joback Calculated Property
Cp,gas 228.86 J/mol×K 606.45 Joback Calculated Property
Cp,gas 234.74 J/mol×K 637.16 Joback Calculated Property
Cp,gas 240.29 J/mol×K 667.86 Joback Calculated Property
Cp,gas 245.53 J/mol×K 698.57 Joback Calculated Property
Cp,gas 250.46 J/mol×K 729.27 Joback Calculated Property

Similar Compounds

2,6-Difluorobenzoic acid. 2,3-Difluorobenzoic acid. 2,5-Difluorobenzoic acid. 2,3,4-Trifluorobenzoic acid. 2,4,5-Trifluorobenzoic acid. 2,4,6-Trifluorobenzoic acid. Benzoic acid, 2-fluoro-. Methyl 2,6-difluorobenzoate. 2,4-Difluorobenzoic acid. 2,3,6-Trifluorobenzyl alcohol. 2,3,6-Trifluorobenzoyl chloride. 2,3,6-Trifluorobenzaldehyde. 2,5-Difluorobenzoic acid, methyl ester. 2-Chloro-6-fluorobenzoic acid. 3-Fluorophthalic acid.

Find more compounds similar to 2,3,6-Trifluorobenzoic acid.

Sources

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