Molecule ID: 7416

IUPAC Name: nitrobenzene

Description: The molecule is a nitroarene consisting of benzene carrying a single nitro substituent. An industrial chemical used widely in the production of aniline. It is a member of nitrobenzenes and a nitroarene.

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

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

InChI: InChI=1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H

Molecular Properties:
- Polar Surface Area: 45.8 Ų
- LogP: 1.9