Chemical Properties of 2,5-Di(trifluoromethyl)benzoic acid, 3-hexadecyl ester

2,5-Di(trifluoromethyl)benzoic acid, 3-hexadecyl ester

InChI
InChI=1S/C25H36F6O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-20(4-2)33-23(32)21-18-19(24(26,27)28)16-17-22(21)25(29,30)31/h16-18,20H,3-15H2,1-2H3
InChI Key
OMNOLIPBWRMFFP-UHFFFAOYSA-N
Formula
C25H36F6O2
SMILES
CCCCCCCCCCCCCC(CC)OC(=O)c1cc(C(F)(F)F)ccc1C(F)(F)F
Molecular Weight1
482.54
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Physical Properties

Property Value Unit Source
ΔfusH° 58.27 kJ/mol Joback Calculated Property
logPoct/wat 9.361 Crippen Calculated Property
McVol 357.410 ml/mol McGowan Calculated Property
Inp [2321.00; 2321.00]   Show Hide
Inp 2321.00 NIST
Inp 2321.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [545.97; 1238.50] 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-1.38170e+01
Coefficient B2.45444e+00
Coefficient C-1.58392e-03
Coefficient D3.81800e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 545.97 J/mol×K 273.00 Calculated Property
Cp,gas 673.17 J/mol×K 353.78 Calculated Property
Cp,gas 785.00 J/mol×K 434.56 Calculated Property
Cp,gas 882.65 J/mol×K 515.33 Calculated Property
Cp,gas 967.33 J/mol×K 596.11 Calculated Property
Cp,gas 1040.26 J/mol×K 676.89 Calculated Property
Cp,gas 1102.63 J/mol×K 757.67 Calculated Property
Cp,gas 1155.66 J/mol×K 838.44 Calculated Property
Cp,gas 1200.54 J/mol×K 919.22 Calculated Property
Cp,gas 1238.50 J/mol×K 1000.00 Calculated Property

Similar Compounds

2,5-Di(trifluoromethyl)benzoic acid, 3-tridecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3-tetradecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3-pentadecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3-dodecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 5-tetradecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-tetradecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-pentadecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-tridecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 7-tridecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-hexadecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 6-dodecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 5-pentadecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 6-pentadecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-dodecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 5-dodecyl ester.

Find more compounds similar to 2,5-Di(trifluoromethyl)benzoic acid, 3-hexadecyl ester.

Sources

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