Molecule ID: 6847

IUPAC Name: naphthalene-1-carboxylic acid

Description: The molecule is a naphthoic acid carrying a carboxy group at position 1. It has a role as a fungal xenobiotic metabolite and a bacterial xenobiotic metabolite. It is a conjugate acid of a 1-naphthoate.

SMILES: O=C(O)c1cccc2ccccc12

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

InChI: InChI=1S/C11H8O2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H,12,13)

Molecular Properties:
- Polar Surface Area: 37.3 Ų
- LogP: 3.1