Chemical Properties of Trans-(3-trifluoromethyl)cinnamin acid, undecyl ester

Trans-(3-trifluoromethyl)cinnamin acid, undecyl ester

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C21H29F3O2/c1-2-3-4-5-6-7-8-9-10-16-26-20(25)15-14-18-12-11-13-19(17-18)21(22,23)24/h11-15,17H,2-10,16H2,1H3/b15-14+
InChI Key
LKWXCSBKAVHDCK-CCEZHUSRSA-N
Formula
C21H29F3O2
SMILES
CCCCCCCCCCCOC(=O)C=Cc1cccc(C(F)(F)F)c1
Molecular Weight1
370.45
Sources

Physical Properties

Property Value Unit Source
Δf -506.57 kJ/mol Joback Calculated Property
Δfgas -976.37 kJ/mol Joback Calculated Property
Δfus 48.61 kJ/mol Joback Calculated Property
Δvap 70.65 kJ/mol Joback Calculated Property
logPoct/wat 6.79 Crippen Calculated Property
Pc 1160.08 kPa Joback Calculated Property
Tboil 786.57 K Joback Calculated Property
Tc 974.30 K Joback Calculated Property
Tfus 436.64 K Joback Calculated Property
Vc 1.15 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 884.20 J/mol×K 786.57 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 3
>C=O (nonring) 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 10
>C< 1
=CH- 2
-CH3 1

Similar Compounds

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.