3-butyl-4-oxidanyl-hexane-2,5-dione

Systemtic Name: 3-butyl-4-oxidanyl-hexane-2,5-dione Openeye Name: 3-butyl-4-hydroxy-hexane-2,5-dione CAS Name: 3-butyl-4-hydroxyhexane-2,5-dione IUPAC Name: 3-butyl-4-hydroxyhexane-2,5-dione Traditional Name: 3-butyl-4-hydroxy-hexane-2,5-dione Formula: C10H18O3 MolecularWeight: 186.24812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C(=O)C)O)C(=O)C

Isomeric SMILES

CCCCC(C(C(=O)C)O)C(=O)C

InChI

InChI=1S/C10H18O3/c1-4-5-6-9(7(2)11)10(13)8(3)12/h9-10,13H,4-6H2,1-3H3