Chemical Properties of 3,4-Difluorobenzoic acid, 2-ethylhexyl ester

3,4-Difluorobenzoic acid, 2-ethylhexyl ester

InChI
InChI=1S/C15H20F2O2/c1-3-5-6-11(4-2)10-19-15(18)12-7-8-13(16)14(17)9-12/h7-9,11H,3-6,10H2,1-2H3
InChI Key
JWASMULRJNZYNO-UHFFFAOYSA-N
Formula
C15H20F2O2
SMILES
CCCCC(CC)COC(=O)c1ccc(F)c(F)c1
Molecular Weight1
270.31
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Physical Properties

Property Value Unit Source
ΔfusH° 34.88 kJ/mol Joback Calculated Property
log10WS -5.65 Relay (1.0) Calculated Property
logPoct/wat 4.338 Crippen Calculated Property
McVol 209.430 ml/mol McGowan Calculated Property
Pc 1687.95 kPa Joback Calculated Property
Inp [1676.00; 1676.00]   Show Hide
Inp 1676.00 NIST
Inp 1676.00 NIST
Tboil 561.96 K Relay (1.0) Calculated Property
Tfus 222.45 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [556.24; 637.95] J/mol×K [635.76; 820.83] Show Hide
Cp,gas 556.24 J/mol×K 635.76 Joback Calculated Property
Cp,gas 571.89 J/mol×K 666.60 Joback Calculated Property
Cp,gas 586.70 J/mol×K 697.45 Joback Calculated Property
Cp,gas 600.69 J/mol×K 728.29 Joback Calculated Property
Cp,gas 613.89 J/mol×K 759.14 Joback Calculated Property
Cp,gas 626.30 J/mol×K 789.98 Joback Calculated Property
Cp,gas 637.95 J/mol×K 820.83 Joback Calculated Property

Similar Compounds

3,4-Difluorobenzoic acid, cyclohexylmethyl ester. 3-Fluorobenzoic acid, 2-methylpentyl ester. 2,4-Difluorobenzoic acid, 2-ethylhexyl ester. 2,5-Difluorobenzoic acid, 2-ethylhexyl ester. 2,4-Difluorobenzoic acid, cyclohexylmethyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2-ethylhexyl ester. 2,4-Difluorobenzoic acid, 2-methylpentyl ester. 4-Fluorobenzoic acid, 2-methylpentyl ester. 2,5-Difluorobenzoic acid, cyclohexylmethyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, cyclohexylmethyl ester. 2-Fluorobenzoic acid, 2-methylpentyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2-methylpentyl ester. 3,4-Difluorobenzoic acid, heptyl ester. 3,4-Difluorobenzoic acid, undecyl ester. 3,4-Difluorobenzoic acid, eicosyl ester.

Find more compounds similar to 3,4-Difluorobenzoic acid, 2-ethylhexyl ester.

Sources

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