butan-2-one; pentane-2,4-dione

Systemtic Name: butan-2-one; pentane-2,4-dione Openeye Name: butan-2-one; pentane-2,4-dione CAS Name: 2-butanone; pentane-2,4-dione IUPAC Name: butan-2-one; pentane-2,4-dione Traditional Name: butan-2-one; pentane-2,4-dione Formula: C9H16O3 MolecularWeight: 172.22154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C.CC(=O)CC(=O)C

Isomeric SMILES

CCC(=O)C.CC(=O)CC(=O)C

InChI

InChI=1S/C5H8O2.C4H8O/c1-4(6)3-5(2)7;1-3-4(2)5/h3H2,1-2H3;3H2,1-2H3