2-(2-phenylpropan-2-ylperoxy)propan-2-ylbenzene; propan-2-ylbenzene

Systemtic Name: 2-(2-phenylpropan-2-ylperoxy)propan-2-ylbenzene; propan-2-ylbenzene Openeye Name: cumene; [1-methyl-1-(1-methyl-1-phenyl-ethyl)peroxy-ethyl]benzene CAS Name: cumene; 2-(2-phenylpropan-2-yldioxy)propan-2-ylbenzene IUPAC Name: cumene; 2-(2-phenylpropan-2-ylperoxy)propan-2-ylbenzene Traditional Name: cumene; (1-cumylperoxy-1-methyl-ethyl)benzene Formula: C27H34O2 MolecularWeight: 390.55766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1.CC(C)(C1=CC=CC=C1)OOC(C)(C)C2=CC=CC=C2

Isomeric SMILES

CC(C)C1=CC=CC=C1.CC(C)(C1=CC=CC=C1)OOC(C)(C)C2=CC=CC=C2

InChI

InChI=1S/C18H22O2.C9H12/c1-17(2,15-11-7-5-8-12-15)19-20-18(3,4)16-13-9-6-10-14-16;1-8(2)9-6-4-3-5-7-9/h5-14H,1-4H3;3-8H,1-2H3