5-methylhexan-2-one; 1-propoxypropan-1-ol

Systemtic Name: 5-methylhexan-2-one; 1-propoxypropan-1-ol Openeye Name: 5-methylhexan-2-one; 1-propoxypropan-1-ol CAS Name: 5-methyl-2-hexanone; 1-propoxy-1-propanol IUPAC Name: 5-methylhexan-2-one; 1-propoxypropan-1-ol Traditional Name: 5-methylhexan-2-one; 1-propoxypropan-1-ol Formula: C13H28O3 MolecularWeight: 232.35962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H14O.C6H14O2/c1-6(2)4-5-7(3)8;1-3-5-8-6(7)4-2/h6H,4-5H2,1-3H3;6-7H,3-5H2,1-2H3