Molecule ID: 17198

IUPAC Name: 1-(4-hydroxy-3,5-dimethoxyphenyl)ethanone

Description: The molecule is a member of the class of acetophenones that is 1-phenylethanone substituted by a hydroxy group at position 4 and methoxy groups at positions 3 and 5. It has a role as a non-steroidal anti-inflammatory drug, an anti-asthmatic drug, a non-narcotic analgesic, a peripheral nervous system drug and a plant metabolite. It is a member of acetophenones, a dimethoxybenzene and a member of phenols.

SMILES: COc1cc(C(C)=O)cc(OC)c1O

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

InChI: InChI=1S/C10H12O4/c1-6(11)7-4-8(13-2)10(12)9(5-7)14-3/h4-5,12H,1-3H3

Molecular Properties:
- Polar Surface Area: 55.8 Ų
- LogP: 0.2