Molecule record

4-nitroaniline

C6H6N2O2

138.13 g/mol

Loading structure

Molecular properties

Formula
C6H6N2O2
Molar mass
138.13 g·mol−1
Exact mass
138.0429 Da
5
PubChem CID
7475

Functional groups

Aromatic ring
Nitro compound
Primary amine

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1-Amino-4-nitrobenzene
  • 100-01-6
  • 4-Nitraniline
  • 4-Nitrobenzenamine
  • Aniline, 4-nitro-
  • Aniline, p-nitro-
  • Azoamine Red ZH
  • Benzenamine, 4-nitro-
Show all 24 synonyms
  • Developer P
  • Devol Red GG
  • Fast Red 2G Base
  • Fast Red Base 2J
  • Fast Red Base GG
  • Fast Red GG Base
  • Fast Red GG Salt
  • Fast Red MP Base
  • Fast Red P Base
  • Fast Red P Salt
  • Nitrazol CF extra
  • p-Aminonitrobenzene
  • p-Nitraniline
  • p-Nitroaniline
  • p-Nitrophenylamine
  • para-Nitroaniline

Structure identifiers

Canonical SMILES
Nc1ccc([N+](=O)[O-])cc1
Isomeric SMILES
C1=CC(=CC=C1N)[N+](=O)[O-]
InChI
InChI=1S/C6H6N2O2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H,7H2
InChIKey
TYMLOMAKGOJONV-UHFFFAOYSA-N
PubChem CID
7475

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 4-nitroaniline; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-nitroaniline; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record