pentan-2-yl hexanoate

Systemtic Name: pentan-2-yl hexanoate Openeye Name: 1-methylbutyl hexanoate CAS Name: hexanoic acid pentan-2-yl ester IUPAC Name: pentan-2-yl hexanoate Traditional Name: hexanoic acid 1-methylbutyl ester Formula: C11H22O2 MolecularWeight: 186.29118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC(C)CCC

Isomeric SMILES

CCCCCC(=O)OC(C)CCC

InChI

InChI=1S/C11H22O2/c1-4-6-7-9-11(12)13-10(3)8-5-2/h10H,4-9H2,1-3H3