Chemical Properties of 3,4-Difluorobenzoic acid, 3,5-difluophenyl ester

3,4-Difluorobenzoic acid, 3,5-difluophenyl ester

InChI
InChI=1S/C13H6F4O2/c14-8-4-9(15)6-10(5-8)19-13(18)7-1-2-11(16)12(17)3-7/h1-6H
InChI Key
DDTYNYKFAFNJCY-UHFFFAOYSA-N
Formula
C13H6F4O2
SMILES
O=C(Oc1cc(F)cc(F)c1)c1ccc(F)c(F)c1
Molecular Weight1
270.18
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Physical Properties

Property Value Unit Source
ΔfusH° 32.64 kJ/mol Joback Calculated Property
logPoct/wat 3.462 Crippen Calculated Property
McVol 161.030 ml/mol McGowan Calculated Property
Inp [1553.00; 1553.00]   Show Hide
Inp 1553.00 NIST
Inp 1553.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [226.08; 477.19] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A3.02300e+01
Coefficient B8.35400e-01
Coefficient C-4.48640e-04
Coefficient D6.02000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 226.08 J/mol×K 273.00 Calculated Property
Cp,gas 272.29 J/mol×K 353.78 Calculated Property
Cp,gas 313.48 J/mol×K 434.56 Calculated Property
Cp,gas 349.83 J/mol×K 515.33 Calculated Property
Cp,gas 381.55 J/mol×K 596.11 Calculated Property
Cp,gas 408.82 J/mol×K 676.89 Calculated Property
Cp,gas 431.82 J/mol×K 757.67 Calculated Property
Cp,gas 450.76 J/mol×K 838.44 Calculated Property
Cp,gas 465.82 J/mol×K 919.22 Calculated Property
Cp,gas 477.19 J/mol×K 1000.00 Calculated Property

Similar Compounds

3-Fluorobenzoic acid, 3,5-difluorophenyl ester. 4-Fluorobenzoic acid, 3,5-difluorophenyl ester. 3,4-Difluorobenzoic acid, phenyl ester. 2,4-Difluorobenzoic acid, 3,5-difluophenyl ester. 2,5-Difluorobenzoic acid, 3,5-difluophenyl ester. 3,4-Difluorobenzoic acid, 4-chlorophenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 3,5-difluophenyl ester. 3,4-Difluorobenzoic acid, 4-methoxyphenyl ester. 2-Fluorobenzoic acid, 3,5-difluorophenyl ester. Benzoic acid, 3,5-difluophenyl ester. 3,4-Difluorobenzoic acid, 4-cyanophenyl ester. 3-Fluorobenzoic acid, phenyl ester. 3,4-Difluorobenzoic acid, 3,4-dichlorophenyl ester. 4-Cyanobenzoic acid, 3,5-difluorophenyl ester. Isophthalic acid, di(3,5-difluorophenyl) ester.

Find more compounds similar to 3,4-Difluorobenzoic acid, 3,5-difluophenyl ester.

Sources

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