hexadecan-4-yl 2-(trifluoromethyl)benzoate

Systemtic Name: hexadecan-4-yl 2-(trifluoromethyl)benzoate Openeye Name: 1-propyltridecyl 2-(trifluoromethyl)benzoate CAS Name: 2-(trifluoromethyl)benzoic acid hexadecan-4-yl ester IUPAC Name: hexadecan-4-yl 2-(trifluoromethyl)benzoate Traditional Name: 2-(trifluoromethyl)benzoic acid 1-propyltridecyl ester Formula: C24H37F3O2 MolecularWeight: 414.54459

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCC)OC(=O)C1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCC(CCC)OC(=O)C1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C24H37F3O2/c1-3-5-6-7-8-9-10-11-12-13-17-20(16-4-2)29-23(28)21-18-14-15-19-22(21)24(25,26)27/h14-15,18-20H,3-13,16-17H2,1-2H3