1,3,4,5,6-pentakis(oxidanyl)hexan-2-one; propan-2-one

Systemtic Name: 1,3,4,5,6-pentakis(oxidanyl)hexan-2-one; propan-2-one Openeye Name: acetone; 1,3,4,5,6-pentahydroxyhexan-2-one CAS Name: 1,3,4,5,6-pentahydroxy-2-hexanone; 2-propanone IUPAC Name: 1,3,4,5,6-pentahydroxyhexan-2-one; propan-2-one Traditional Name: acetone; 1,3,4,5,6-pentahydroxyhexan-2-one Formula: C9H18O7 MolecularWeight: 238.23502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C.C(C(C(C(C(=O)CO)O)O)O)O

Isomeric SMILES

CC(=O)C.C(C(C(C(C(=O)CO)O)O)O)O

InChI

InChI=1S/C6H12O6.C3H6O/c7-1-3(9)5(11)6(12)4(10)2-8;1-3(2)4/h3,5-9,11-12H,1-2H2;1-2H3