Chemical Properties of 3-Chloro-2-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

InChI
InChI=1S/C12H6ClF9O2/c13-6-3-1-2-5(7(6)14)8(23)24-4-10(17,18)12(21,22)11(19,20)9(15)16/h1-3,9H,4H2
InChI Key
YBSFCAMNTKNDEA-UHFFFAOYSA-N
Formula
C12H6ClF9O2
SMILES
O=C(OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1cccc(Cl)c1F
Molecular Weight1
388.61
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Physical Properties

Property Value Unit Source
ΔfusH° 30.62 kJ/mol Joback Calculated Property
logPoct/wat 4.807 Crippen Calculated Property
McVol 191.790 ml/mol McGowan Calculated Property
Inp [1506.00; 1506.00]   Show Hide
Inp 1506.00 NIST
Inp 1506.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [306.73; 598.77] 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 A4.69100e+00
Coefficient B1.38740e+00
Coefficient C-1.11812e-03
Coefficient D3.24800e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 306.73 J/mol×K 273.00 Calculated Property
Cp,gas 369.96 J/mol×K 353.78 Calculated Property
Cp,gas 423.10 J/mol×K 434.56 Calculated Property
Cp,gas 467.18 J/mol×K 515.33 Calculated Property
Cp,gas 503.21 J/mol×K 596.11 Calculated Property
Cp,gas 532.24 J/mol×K 676.89 Calculated Property
Cp,gas 555.28 J/mol×K 757.67 Calculated Property
Cp,gas 573.37 J/mol×K 838.44 Calculated Property
Cp,gas 587.52 J/mol×K 919.22 Calculated Property
Cp,gas 598.77 J/mol×K 1000.00 Calculated Property

Similar Compounds

3-Chloro-2-fluorobenzoic acid, 2,2,3,3,4,4,4-heptafluorobutyl ester. 2-Fluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 2,4-Difluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 2-Chlorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 3-Fluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 4-Chlorobenzoic 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. 4-Fluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 3-Chloro-2-fluorobenzoic acid, 4-methoxy-2-methylbutyl ester. 3-Methoxy-2,4,5-trifluorobenzoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. 3-Chloro-2-fluorobenzoic acid, pentyl ester. 3-Chloro-2-fluorobenzoic acid, butyl ester. 1,5-Pentanediol, O,O'-bis(3-chloro-2-fluorobenzoyl)-. 3-Chlorobenzoic acid, 2,2,3,3,4,4,4-heptafluorobutyl ester. 3-Chloro-2-fluorobenzoic acid, 6-chlorohexyl ester.

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

Sources

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