Chemical Properties of trans-(3-Trifluoromethyl)cinnamic acid, nonyl ester

trans-(3-Trifluoromethyl)cinnamic acid, nonyl ester

InChI
InChI=1S/C19H25F3O2/c1-2-3-4-5-6-7-8-14-24-18(23)13-12-16-10-9-11-17(15-16)19(20,21)22/h9-13,15H,2-8,14H2,1H3/b13-12+
InChI Key
RMUQIZULBDUYGZ-OUKQBFOZSA-N
Formula
C19H25F3O2
SMILES
CCCCCCCCCOC(=O)C=Cc1cccc(C(F)(F)F)c1
Molecular Weight1
342.40
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Physical Properties

Property Value Unit Source
ΔfusH° 45.01 kJ/mol Joback Calculated Property
IE 9.17 eV Relay (1.0) Calculated Property
log10WS -6.63 Relay (1.0) Calculated Property
logPoct/wat 6.012 Crippen Calculated Property
McVol 263.260 ml/mol McGowan Calculated Property
Pc 1289.29 kPa Joback Calculated Property
Inp [2131.30; 2131.30]   Show Hide
Inp 2131.30 NIST
Inp 2131.30 NIST
Tboil 608.81 K Relay (1.0) Calculated Property
Tfus 310.24 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [379.31; 878.20] 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-2.89620e+01
Coefficient B1.79682e+00
Coefficient C-1.18416e-03
Coefficient D2.94500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 379.31 J/mol×K 273.00 Calculated Property
Cp,gas 471.55 J/mol×K 353.78 Calculated Property
Cp,gas 552.41 J/mol×K 434.56 Calculated Property
Cp,gas 622.83 J/mol×K 515.33 Calculated Property
Cp,gas 683.74 J/mol×K 596.11 Calculated Property
Cp,gas 736.06 J/mol×K 676.89 Calculated Property
Cp,gas 780.74 J/mol×K 757.67 Calculated Property
Cp,gas 818.70 J/mol×K 838.44 Calculated Property
Cp,gas 850.88 J/mol×K 919.22 Calculated Property
Cp,gas 878.20 J/mol×K 1000.00 Calculated Property

Similar Compounds

trans-3-(Trifluoromethyl)cinnamic acid, octadecyl ester. trans-3-(Trifluoromethyl)cinnamic acid, tridecyl ester. trans-(3-Trifluoromethyl)cinnamin acid, heptadecyl ester. trans-3-(Trifluoromethyl)cinnamic acid, heptyl ester. trans-3-(Trifluoromethyl)cinnamic acid, octyl ester. trans-3-(Trifluoromethyl)cinnamic acid, pentadecyl ester. trans-3-(Trifluoromethyl)cinnamic acid, tetradecyl ester. trans-3-(Trifluoromethyl)cinnamic acid, decyl ester. trans-(3-Trifluoromethyl)cinnamin acid, undecyl ester. trans-3-(Trifluoromethyl)cinnamic acid, hexadecyl ester. Trans-3-(trifluoromethyl)cinnamic acid, hexyl ester. trans-3-(Trifluoromethyl)cinnamic acid, pentyl ester. trans-3-(Trifluoromethyl)cinnamic acid, butyl ester. trans-(3-trifluoromethyl)cinnamin acid, dodec-9-ynyl ester. trans-3-(Trifluoromethyl)cinnamic acid, undec-10-enyl ester.

Find more compounds similar to trans-(3-Trifluoromethyl)cinnamic acid, nonyl ester.

Sources

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