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

2,5-Di(trifluoromethyl)benzoic acid, isohexyl ester

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InChI
InChI=1S/C15H16F6O2/c1-9(2)4-3-7-23-13(22)11-8-10(14(16,17)18)5-6-12(11)15(19,20)21/h5-6,8-9H,3-4,7H2,1-2H3
InChI Key
HPPDABQLSVHGCZ-UHFFFAOYSA-N
Formula
C15H16F6O2
SMILES
CC(C)CCCOC(=O)c1cc(C(F)(F)F)ccc1C(F)(F)F
Molecular Weight1
342.28
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Physical Properties

Property Value Unit Source
Δf -1230.97 kJ/mol Joback Calculated Property
Δfgas -1583.58 kJ/mol Joback Calculated Property
Δfus 30.79 kJ/mol Joback Calculated Property
Δvap 53.86 kJ/mol Joback Calculated Property
log10WS -5.77 Crippen Calculated Property
logPoct/wat 5.317 Crippen Calculated Property
McVol 216.510 ml/mol McGowan Calculated Property
Pc 1556.12 kPa Joback Calculated Property
Inp [1420.00; 1420.00]   Show
Inp 1420.00 NIST
Inp 1420.00 NIST
Tboil 644.25 K Joback Calculated Property
Tc 820.91 K Joback Calculated Property
Tfus 375.81 K Joback Calculated Property
Vc 0.872 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [599.92; 672.36] J/mol×K [644.25; 820.91] Show
T(K)
Ideal gas heat capacity (J/mol×K)
600
610
620
630
640
650
660
670
650
700
750
800
Cp,gas 599.92 J/mol×K 644.25 Joback Calculated Property
Cp,gas 613.98 J/mol×K 673.69 Joback Calculated Property
Cp,gas 627.19 J/mol×K 703.14 Joback Calculated Property
Cp,gas 639.59 J/mol×K 732.58 Joback Calculated Property
Cp,gas 651.23 J/mol×K 762.02 Joback Calculated Property
Cp,gas 662.14 J/mol×K 791.47 Joback Calculated Property
Cp,gas 672.36 J/mol×K 820.91 Joback Calculated Property

Similar Compounds

2,5-Di(trifluoromethyl)benzoic acid, pentyl ester. 2,5-Di(trifluoromethyl)benzoic acid, hexyl ester. 2,5-Di(trifluoromethyl)benzoic acid, teradecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, heptyl ester. 2,5-Di(trifluoromethyl)benzoic acid, eicosyl ester. 2,5-Di(trifluoromethyl)benzoic acid, undecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, nonyl ester. 2,5-Di(trifluoromethyl)benzoic acid, hexadecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, heptadecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, nonadecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, octyl ester. 2,5-Di(trifluoromethyl)benzoic acid, pentadecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, octadecyl ester. 2,5-Di(trifluoromethyl)benzoic acid, decyl ester. 2,5-Di(trifluoromethyl)benzoic acid, tridecyl ester.

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

Sources

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