5-ethylheptan-3-one hydrochloride

Systemtic Name: 5-ethylheptan-3-one hydrochloride Openeye Name: 5-ethylheptan-3-one hydrochloride CAS Name: 5-ethyl-3-heptanone hydrochloride IUPAC Name: 5-ethylheptan-3-one hydrochloride Traditional Name: 5-ethylheptan-3-one hydrochloride Formula: C9H19ClO MolecularWeight: 178.69956

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CC(=O)CC.Cl

Isomeric SMILES

CCC(CC)CC(=O)CC.Cl

InChI

InChI=1S/C9H18O.ClH/c1-4-8(5-2)7-9(10)6-3;/h8H,4-7H2,1-3H3;1H