Molecule ID: 11087

IUPAC Name: 2-nitrobenzoic acid

Description: The molecule is a nitrobenzoic acid carrying the nitro substituent at position 2. It derives from a benzoic acid. It is a conjugate acid of a 2-nitrobenzoate.

SMILES: O=C(O)c1ccccc1[N+](=O)[O-]

SELFIES: [O][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1]

InChI: InChI=1S/C7H5NO4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)

Molecular Properties:
- Polar Surface Area: 83.1 Ų
- LogP: 1.5