Chemical Properties of 4-Fluoro-2-trifluoromethylbenzoic acid, isopropyl ester

4-Fluoro-2-trifluoromethylbenzoic acid, isopropyl ester

InChI
InChI=1S/C11H10F4O2/c1-6(2)17-10(16)8-4-3-7(12)5-9(8)11(13,14)15/h3-6H,1-2H3
InChI Key
SMWJEEBZTJQZCA-UHFFFAOYSA-N
Formula
C11H10F4O2
SMILES
CC(C)OC(=O)c1ccc(F)cc1C(F)(F)F
Molecular Weight1
250.19
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Physical Properties

Property Value Unit Source
ΔfusH° 23.26 kJ/mol Joback Calculated Property
logPoct/wat 3.410 Crippen Calculated Property
McVol 156.610 ml/mol McGowan Calculated Property
Inp [1176.00; 1176.00]   Show Hide
Inp 1176.00 NIST
Inp 1176.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [234.04; 500.62] 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 A1.12000e+01
Coefficient B9.75040e-01
Coefficient C-6.17720e-04
Coefficient D1.32100e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 234.04 J/mol×K 273.00 Calculated Property
Cp,gas 284.68 J/mol×K 353.78 Calculated Property
Cp,gas 329.10 J/mol×K 434.56 Calculated Property
Cp,gas 367.70 J/mol×K 515.33 Calculated Property
Cp,gas 400.91 J/mol×K 596.11 Calculated Property
Cp,gas 429.14 J/mol×K 676.89 Calculated Property
Cp,gas 452.80 J/mol×K 757.67 Calculated Property
Cp,gas 472.33 J/mol×K 838.44 Calculated Property
Cp,gas 488.13 J/mol×K 919.22 Calculated Property
Cp,gas 500.62 J/mol×K 1000.00 Calculated Property

Similar Compounds

4-Fluoro-2-trifluoromethylbenzoic acid, ethyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, isopropyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, propyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, ethyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, neopentyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 2-methoxyethyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, propyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 2-ethoxyethyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 2-pentyl ester. 2,5-Di(trifluoromethyl)benzoic acid, isopropyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 2-dimethylaminoethyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, isobutyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, pentyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, hexyl ester. 1,5-Pentanediol, O,O'-di(4-fluoro-2-trifluoromethylbenzoyl)-.

Find more compounds similar to 4-Fluoro-2-trifluoromethylbenzoic acid, isopropyl ester.

Sources

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