2-ethylhexyl 7,7-dimethyloctanoate

Systemtic Name: 2-ethylhexyl 7,7-dimethyloctanoate Openeye Name: 2-ethylhexyl 7,7-dimethyloctanoate CAS Name: 7,7-dimethyloctanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 7,7-dimethyloctanoate Traditional Name: 7,7-dimethylcaprylic acid 2-ethylhexyl ester Formula: C18H36O2 MolecularWeight: 284.47724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)CCCCCC(C)(C)C

Isomeric SMILES

CCCCC(CC)COC(=O)CCCCCC(C)(C)C

InChI

InChI=1S/C18H36O2/c1-6-8-12-16(7-2)15-20-17(19)13-10-9-11-14-18(3,4)5/h16H,6-15H2,1-5H3