Chemical Properties of 2,4-Difluorobenzoic acid, pentafluorophenyl ester

2,4-Difluorobenzoic acid, pentafluorophenyl ester

InChI
InChI=1S/C13H3F7O2/c14-4-1-2-5(6(15)3-4)13(21)22-12-10(19)8(17)7(16)9(18)11(12)20/h1-3H
InChI Key
ZDBKOPSCVKQWAX-UHFFFAOYSA-N
Formula
C13H3F7O2
SMILES
O=C(Oc1c(F)c(F)c(F)c(F)c1F)c1ccc(F)cc1F
Molecular Weight1
324.15
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Physical Properties

Property Value Unit Source
ΔfusH° 40.71 kJ/mol Joback Calculated Property
logPoct/wat 3.880 Crippen Calculated Property
McVol 166.340 ml/mol McGowan Calculated Property
Inp [1454.00; 1454.00]   Show Hide
Inp 1454.00 NIST
Inp 1454.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [258.33; 489.28] 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 A9.14000e+01
Coefficient B6.92300e-01
Coefficient C-2.96720e-04
Coefficient D2.30000e-09
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 258.33 J/mol×K 273.00 Calculated Property
Cp,gas 299.29 J/mol×K 353.78 Calculated Property
Cp,gas 336.40 J/mol×K 434.56 Calculated Property
Cp,gas 369.68 J/mol×K 515.33 Calculated Property
Cp,gas 399.14 J/mol×K 596.11 Calculated Property
Cp,gas 424.77 J/mol×K 676.89 Calculated Property
Cp,gas 446.60 J/mol×K 757.67 Calculated Property
Cp,gas 464.62 J/mol×K 838.44 Calculated Property
Cp,gas 478.84 J/mol×K 919.22 Calculated Property
Cp,gas 489.28 J/mol×K 1000.00 Calculated Property

Similar Compounds

2-Fluorobenzoic acid, pentafluorophenyl ester. 4-Fluorobenzoic acid, pentafluorophenyl ester. 3-Fluorobenzoic acid, pentafluorophenyl ester. 2,4-Difluorobenzoic acid, 3,5-difluophenyl ester. 3-Chloro-2-fluorobenzoic acid, pentafluorophenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, pentafluorophenyl ester. 2-Fluorobenzoic acid, 3,5-difluorophenyl ester. 3-Methoxy-2,4,5-trifluorobenzoic acid, pentafluorophenyl ester. 2,4-Difluorobenzoic acid, phenyl ester. 2,4-Difluorobenzoic acid, 4-methoxyphenyl ester. Benzoic acid, pentafluorophenyl ester. 2,4-Difluorobenzoic acid, 4-cyanophenyl ester. 2,4-Difluorobenzoic acid, 4-chlorophenyl ester. 2,5-Difluorobenzoic acid, 3,5-difluophenyl ester. Terephthalic acid, methyl 2,3,4-trifluorophenyl ester.

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

Sources

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