Molecule ID: 3014064

IUPAC Name: 2,6-di(propan-2-yl)benzene-1,4-diol

Description: The molecule is a hydroquinone that is propofol which is substituted by a hydroxy group at position 4. It is a metabolite of the short acting anaesthetic drug, propofol. It has a role as a drug metabolite. It derives from a propofol.

SMILES: CC(C)c1cc(O)cc(C(C)C)c1O

SELFIES: [C][C][Branch1][C][C][C][=C][C][Branch1][C][O][=C][C][Branch1][=Branch1][C][Branch1][C][C][C][=C][Ring1][#Branch2][O]

InChI: InChI=1S/C12H18O2/c1-7(2)10-5-9(13)6-11(8(3)4)12(10)14/h5-8,13-14H,1-4H3

Molecular Properties:
- Polar Surface Area: 40.5 Ų
- LogP: 3.5