methylbenzene

Systemtic Name: methylbenzene Openeye Name: toluene CAS Name: toluene IUPAC Name: toluene Traditional Name: toluene Formula: C28H32 MolecularWeight: 368.55368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.CC1=CC=CC=C1.CC1=CC=CC=C1.CC1=CC=CC=C1

Isomeric SMILES

CC1=CC=CC=C1.CC1=CC=CC=C1.CC1=CC=CC=C1.CC1=CC=CC=C1

InChI

InChI=1S/4C7H8/c4*1-7-5-3-2-4-6-7/h4*2-6H,1H3