Molecule ID: 16204067

IUPAC Name: 3-(3-hydroxy-5-methylphenoxy)-5-methylbenzene-1,2-diol

Description: The molecule is a catechol that is 5-methylbenzene-1,2-diol bearing a 3-hydroxy-5-methylphenoxy substituent at position 3. It has a role as a metabolite, an antimalarial, an anti-HSV-1 agent, an antimycobacterial drug and an antineoplastic agent. It is a member of catechols and an aromatic ether. It derives from a diphenyl ether.

SMILES: Cc1cc(O)cc(Oc2cc(C)cc(O)c2O)c1

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

InChI: InChI=1S/C14H14O4/c1-8-3-10(15)7-11(4-8)18-13-6-9(2)5-12(16)14(13)17/h3-7,15-17H,1-2H3

Molecular Properties:
- Polar Surface Area: 69.9 Ų
- LogP: 3.1