butanoic acid; cyclohexane; hexane

Systemtic Name: butanoic acid; cyclohexane; hexane Openeye Name: butyric acid; cyclohexane; hexane CAS Name: butanoic acid; cyclohexane; hexane IUPAC Name: butanoic acid; cyclohexane; hexane Traditional Name: butyric acid; cyclohexane; n-hexane Formula: C16H34O2 MolecularWeight: 258.43996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC.CCCC(=O)O.C1CCCCC1

Isomeric SMILES

CCCCCC.CCCC(=O)O.C1CCCCC1

InChI

InChI=1S/C6H12.C6H14.C4H8O2/c1-2-4-6-5-3-1;1-3-5-6-4-2;1-2-3-4(5)6/h1-6H2;3-6H2,1-2H3;2-3H2,1H3,(H,5,6)