Molecule ID: 17765246

IUPAC Name: 1,4-dioxonaphthalene-2-carboxylic acid

Description: The molecule is a dioxo monocarboxylic acid that is 1,4-naphthoquinone substituted at position 2 by a carboxy group. It is a dioxo monocarboxylic acid and a member of 1,4-naphthoquinones. It derives from a 1,4-naphthoquinone. It is a conjugate acid of a 1,4-naphthoquinone-2-carboxylate.

SMILES: O=C(O)C1=CC(=O)c2ccccc2C1=O

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

InChI: InChI=1S/C11H6O4/c12-9-5-8(11(14)15)10(13)7-4-2-1-3-6(7)9/h1-5H,(H,14,15)

Molecular Properties:
- Polar Surface Area: 71.4 Ų
- LogP: 2.1