5-methylhexyl hexanoate

Systemtic Name: 5-methylhexyl hexanoate Openeye Name: 5-methylhexyl hexanoate CAS Name: hexanoic acid 5-methylhexyl ester IUPAC Name: 5-methylhexyl hexanoate Traditional Name: hexanoic acid 5-methylhexyl ester Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCCCCC(C)C

Isomeric SMILES

CCCCCC(=O)OCCCCC(C)C

InChI

InChI=1S/C13H26O2/c1-4-5-6-10-13(14)15-11-8-7-9-12(2)3/h12H,4-11H2,1-3H3