Molecule ID: 12574

IUPAC Name: 1-iodo-3-nitrobenzene

Description: The molecule is a C-nitro compound that is nitrobenzene bearing an iodine substituent at C-3. It is a C-nitro compound and an organoiodine compound.

SMILES: O=[N+]([O-])c1cccc(I)c1

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

InChI: InChI=1S/C6H4INO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H

Molecular Properties:
- Polar Surface Area: 45.8 Ų
- LogP: 2.9