Molecule ID: 4739928

IUPAC Name: 2-iodobenzoate

Description: The molecule is an iodobenzoate with a single iodo substituent placed at the 2-position. It is an iodobenzoate and a 2-halobenzoate. It is a conjugate base of a 2-iodobenzoic acid.

SMILES: O=C([O-])c1ccccc1I

SELFIES: [O][=C][Branch1][C][O-1][C][=C][C][=C][C][=C][Ring1][=Branch1][I]

InChI: InChI=1S/C7H5IO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)/p-1

Molecular Properties:
- Polar Surface Area: 40.1 Ų
- LogP: 3.0