cyclohexylbenzene; hydrogen peroxide; propan-2-ylbenzene

Systemtic Name: cyclohexylbenzene; hydrogen peroxide; propan-2-ylbenzene Openeye Name: cumene; cyclohexylbenzene; hydrogen peroxide CAS Name: cumene; cyclohexylbenzene; hydrogen peroxide IUPAC Name: cumene; cyclohexylbenzene; hydrogen peroxide Traditional Name: cumene; cyclohexylbenzene; hydrogen peroxide Formula: C21H30O2 MolecularWeight: 314.4617

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1.C1CCC(CC1)C2=CC=CC=C2.OO

Isomeric SMILES

CC(C)C1=CC=CC=C1.C1CCC(CC1)C2=CC=CC=C2.OO

InChI

InChI=1S/C12H16.C9H12.H2O2/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-8(2)9-6-4-3-5-7-9;1-2/h1,3-4,7-8,12H,2,5-6,9-10H2;3-8H,1-2H3;1-2H