Chemical Properties of Formic acid, (2,3,6-trifluorophenyl)methyl ester

Formic acid, (2,3,6-trifluorophenyl)methyl ester

InChI
InChI=1S/C8H5F3O2/c9-6-1-2-7(10)8(11)5(6)3-13-4-12/h1-2,4H,3H2
InChI Key
RCDQDOHXUOHABJ-UHFFFAOYSA-N
Formula
C8H5F3O2
SMILES
O=COCc1c(F)ccc(F)c1F
Molecular Weight1
190.12
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Physical Properties

Property Value Unit Source
ΔfusH° 22.07 kJ/mol Joback Calculated Property
logPoct/wat 1.777 Crippen Calculated Property
McVol 112.570 ml/mol McGowan Calculated Property
Inp [1098.00; 1098.00]   Show Hide
Inp 1098.00 NIST
Inp 1098.00 NIST
Tboil 461.71 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [240.54; 286.24] J/mol×K [492.95; 679.37] Show Hide
Cp,gas 240.54 J/mol×K 492.95 Joback Calculated Property
Cp,gas 249.03 J/mol×K 524.02 Joback Calculated Property
Cp,gas 257.18 J/mol×K 555.09 Joback Calculated Property
Cp,gas 264.97 J/mol×K 586.16 Joback Calculated Property
Cp,gas 272.41 J/mol×K 617.23 Joback Calculated Property
Cp,gas 279.50 J/mol×K 648.30 Joback Calculated Property
Cp,gas 286.24 J/mol×K 679.37 Joback Calculated Property

Similar Compounds

Acetic acid, (2,3,6-trifluorophenyl)methyl ester. 2,3,6-Trifluorobenzyl alcohol. 2,3,6-Trifluorobenzyl alcohol, chlorodifluoroacetate. 2,3,6-Trifluorobenzyl alcohol, isopropyl ether. Benzoic acid, (2,3,6-trifluorophenyl)methyl ester. Formic acid, (2,3,4,5-tetrafluorophenyl)methyl ester. 2,3,6-Trifluorobenzyl alcohol, n-propyl ether. Succinic acid, di(2,3,6-trifluorobenzyl) ester. 2,3,6-Trifluorobenzyl alcohol,2-methylpropyl ether. Formic acid, (2-fluorophenyl)methyl ester. Glutaric acid, di(2,3,6-trifluorobenzyl) ester. Terephthalic acid, di(2,3,5-trifluorobenzyl) ester. Succinic acid, ethyl 2,3,6-trifluorobenzyl ester. 2,3-Difluorobenzyl alcohol. 2,3,6-Trifluorobenzyl alcohol, n-butyl ether.

Find more compounds similar to Formic acid, (2,3,6-trifluorophenyl)methyl ester.

Sources

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