Molecule ID: 12896

IUPAC Name: 4-[(4-nitrophenyl)diazenyl]aniline

Description: The molecule is azobenzene substituted at the phenyl 4-positions by an amino and a nitro group. It has a role as a dye and an allergen. It is a member of azobenzenes and a primary arylamine. It derives from an azobenzene.

SMILES: Nc1ccc(N=Nc2ccc([N+](=O)[O-])cc2)cc1

SELFIES: [N][C][=C][C][=C][Branch2][Ring1][C][N][=N][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][=C][Ring1][P]

InChI: InChI=1S/C12H10N4O2/c13-9-1-3-10(4-2-9)14-15-11-5-7-12(8-6-11)16(17)18/h1-8H,13H2

Molecular Properties:
- Polar Surface Area: 96.6 Ų
- LogP: 3.2