Chemical Properties of 2-Fluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester

2-Fluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester

InChI
InChI=1S/C12H7F9O2/c13-7-4-2-1-3-6(7)8(22)23-5-10(16,17)12(20,21)11(18,19)9(14)15/h1-4,9H,5H2
InChI Key
VDYJVYYWQQNSTC-UHFFFAOYSA-N
Formula
C12H7F9O2
SMILES
O=C(OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccccc1F
Molecular Weight1
354.17
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Physical Properties

Property Value Unit Source
ΔfusH° 26.81 kJ/mol Joback Calculated Property
logPoct/wat 4.154 Crippen Calculated Property
McVol 179.550 ml/mol McGowan Calculated Property
Inp [1332.00; 1332.00]   Show Hide
Inp 1332.00 NIST
Inp 1332.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [290.77; 593.54] 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 A-2.24990e+01
Coefficient B1.44010e+00
Coefficient C-1.16476e-03
Coefficient D3.40700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 290.77 J/mol×K 273.00 Calculated Property
Cp,gas 356.28 J/mol×K 353.78 Calculated Property
Cp,gas 411.31 J/mol×K 434.56 Calculated Property
Cp,gas 456.94 J/mol×K 515.33 Calculated Property
Cp,gas 494.23 J/mol×K 596.11 Calculated Property
Cp,gas 524.28 J/mol×K 676.89 Calculated Property
Cp,gas 548.16 J/mol×K 757.67 Calculated Property
Cp,gas 566.95 J/mol×K 838.44 Calculated Property
Cp,gas 581.71 J/mol×K 919.22 Calculated Property
Cp,gas 593.54 J/mol×K 1000.00 Calculated Property

Similar Compounds

2,4-Difluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 3-Fluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 3-Chloro-2-fluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 4-Fluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. Benzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. Isophthalic acid, di(2,2,3,3,4,4,5,5-octafluoropentyl) ester. 6-Fluoro-3-trifluoromethylbenzoic acid, 2,2,3,3,4,4,4-heptafluorobutyl ester. 3-Chloro-2-fluorobenzoic acid, 2,2,3,3,4,4,4-heptafluorobutyl ester. Benzoic acid, 3-methyl-, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 4-Methylbenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 3-Trifluoromethylbenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 1-Naphthoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 3-Bromobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 4-Chlorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Find more compounds similar to 2-Fluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Sources

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