octane; propan-2-ylbenzene

Systemtic Name: octane; propan-2-ylbenzene Openeye Name: cumene; octane CAS Name: cumene; octane IUPAC Name: cumene; octane Traditional Name: cumene; n-octane Formula: C17H30 MolecularWeight: 234.4201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC.CC(C)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCC.CC(C)C1=CC=CC=C1

InChI

InChI=1S/C9H12.C8H18/c1-8(2)9-6-4-3-5-7-9;1-3-5-7-8-6-4-2/h3-8H,1-2H3;3-8H2,1-2H3