3,5,5-trimethylhexyl dodecanoate

Systemtic Name: 3,5,5-trimethylhexyl dodecanoate Openeye Name: 3,5,5-trimethylhexyl dodecanoate CAS Name: dodecanoic acid 3,5,5-trimethylhexyl ester IUPAC Name: 3,5,5-trimethylhexyl dodecanoate Traditional Name: lauric acid 3,5,5-trimethylhexyl ester Formula: C21H42O2 MolecularWeight: 326.55698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCCC(C)CC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCC(=O)OCCC(C)CC(C)(C)C

InChI

InChI=1S/C21H42O2/c1-6-7-8-9-10-11-12-13-14-15-20(22)23-17-16-19(2)18-21(3,4)5/h19H,6-18H2,1-5H3