3,5,5-trimethylhexyl 2-ethylhexanoate

Systemtic Name: 3,5,5-trimethylhexyl 2-ethylhexanoate Openeye Name: 3,5,5-trimethylhexyl 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid 3,5,5-trimethylhexyl ester IUPAC Name: 3,5,5-trimethylhexyl 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid 3,5,5-trimethylhexyl ester Formula: C17H34O2 MolecularWeight: 270.45066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)OCCC(C)CC(C)(C)C

Isomeric SMILES

CCCCC(CC)C(=O)OCCC(C)CC(C)(C)C

InChI

InChI=1S/C17H34O2/c1-7-9-10-15(8-2)16(18)19-12-11-14(3)13-17(4,5)6/h14-15H,7-13H2,1-6H3