octan-4-yl pentanoate

Systemtic Name: octan-4-yl pentanoate Openeye Name: 1-propylpentyl pentanoate CAS Name: pentanoic acid octan-4-yl ester IUPAC Name: octan-4-yl pentanoate Traditional Name: valeric acid 1-propylpentyl ester Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)OC(=O)CCCC

Isomeric SMILES

CCCCC(CCC)OC(=O)CCCC

InChI

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