Molecule ID: 3806

IUPAC Name: 5-hydroxynaphthalene-1,4-dione

Description: The molecule is a hydroxy-1,4-naphthoquinone that is 1,4-naphthoquinone in which the hydrogen at position 5 has been replaced by a hydroxy group. A plant-derived 1,4-naphthoquinone with confirmed antibacterial and antitumor activities. It has a role as a herbicide.

SMILES: O=C1C=CC(=O)c2c(O)cccc21

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

InChI: InChI=1S/C10H6O3/c11-7-4-5-9(13)10-6(7)2-1-3-8(10)12/h1-5,12H

Molecular Properties:
- Polar Surface Area: 54.4 Ų
- LogP: 1.9