hexyl 4-methylpentanoate

Systemtic Name: hexyl 4-methylpentanoate Openeye Name: hexyl 4-methylpentanoate CAS Name: 4-methylpentanoic acid hexyl ester IUPAC Name: hexyl 4-methylpentanoate Traditional Name: 4-methylvaleric acid hexyl ester Formula: C12H24O2 MolecularWeight: 200.31776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCC(C)C

Isomeric SMILES

CCCCCCOC(=O)CCC(C)C

InChI

InChI=1S/C12H24O2/c1-4-5-6-7-10-14-12(13)9-8-11(2)3/h11H,4-10H2,1-3H3