methylbenzene; propan-2-one

Systemtic Name: methylbenzene; propan-2-one Openeye Name: acetone; toluene CAS Name: 2-propanone; toluene IUPAC Name: propan-2-one; toluene Traditional Name: acetone; toluene Formula: C10H14O MolecularWeight: 150.21756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.CC(=O)C

Isomeric SMILES

CC1=CC=CC=C1.CC(=O)C

InChI

InChI=1S/C7H8.C3H6O/c1-7-5-3-2-4-6-7;1-3(2)4/h2-6H,1H3;1-2H3