Chemical Properties of Trans-3-(trifluoromethyl)cinnamic acid, hexyl ester

Trans-3-(trifluoromethyl)cinnamic acid, hexyl ester

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InChI
InChI=1S/C16H19F3O2/c1-2-3-4-5-11-21-15(20)10-9-13-7-6-8-14(12-13)16(17,18)19/h6-10,12H,2-5,11H2,1H3/b10-9+
InChI Key
RJHBSTPQTPVUIW-MDZDMXLPSA-N
Formula
C16H19F3O2
SMILES
CCCCCCOC(=O)C=Cc1cccc(C(F)(F)F)c1
Molecular Weight1
300.32
Sources

Physical Properties

Property Value Unit Source
Δf -548.67 kJ/mol Joback Calculated Property
Δfgas -873.17 kJ/mol Joback Calculated Property
Δfus 35.66 kJ/mol Joback Calculated Property
Δvap 59.52 kJ/mol Joback Calculated Property
logPoct/wat 4.84 Crippen Calculated Property
Pc 1657.84 kPa Joback Calculated Property
Tboil 672.17 K Joback Calculated Property
Tc 861.78 K Joback Calculated Property
Tfus 380.29 K Joback Calculated Property
Vc 0.87 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 604.07 J/mol×K 672.17 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 3
=CH- (ring) 4
=C< (ring) 2
-CH2- 5
>C< 1
=CH- 2
-CH3 1
>C=O (nonring) 1

Similar Compounds

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

Find more compounds similar to Trans-3-(trifluoromethyl)cinnamic acid, hexyl ester.

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