2-octyldodecyl 3,5,5-trimethylhexanoate

Systemtic Name: 2-octyldodecyl 3,5,5-trimethylhexanoate Openeye Name: 2-octyldodecyl 3,5,5-trimethylhexanoate CAS Name: 3,5,5-trimethylhexanoic acid 2-octyldodecyl ester IUPAC Name: 2-octyldodecyl 3,5,5-trimethylhexanoate Traditional Name: 3,5,5-trimethylhexanoic acid 2-octyldodecyl ester Formula: C29H58O2 MolecularWeight: 438.76962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCC)COC(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCC)COC(=O)CC(C)CC(C)(C)C

InChI

InChI=1S/C29H58O2/c1-7-9-11-13-15-16-18-20-22-27(21-19-17-14-12-10-8-2)25-31-28(30)23-26(3)24-29(4,5)6/h26-27H,7-25H2,1-6H3