Molecule record

1-bromo-4-nitrobenzene

C6H4BrNO2

202.01 g/mol

Loading structure

Molecular properties

Formula
C6H4BrNO2
Molar mass
202.01 g·mol−1
Exact mass
200.9425 Da
5
PubChem CID
11466

Functional groups

Aromatic ring
Aryl halide
Nitro compound

Physical properties

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

Common names and synonyms

  • 1-bromo-4-nitro-benzene
  • 209-583-8
  • 4-Bromonitrobenzene
  • 4-Nitro-bromobenzene
  • 4-Nitrobromobenzene
  • 4-Nitrophenyl bromide
  • 4-bromo-1-nitrobenzene
  • 586-78-7
Show all 24 synonyms
  • AI3-15384
  • Benzene, 1-bromo-4-nitro-
  • CCRIS 3115
  • DTXCID6042442
  • DTXSID7060415
  • EINECS 209-583-8
  • MFCD00007280
  • NSC-3526
  • P-BROMONITROBENZENE
  • RefChem:430669
  • W2D6WLV889
  • p-Nitrobromobenzene
  • p-Nitrophenyl bromide
  • p-bromo nitrobenzene
  • p-nitro-bromobenzene
  • p-nitrophenylbromide

Structure identifiers

Canonical SMILES
O=[N+]([O-])c1ccc(Br)cc1
Isomeric SMILES
C1=CC(=CC=C1[N+](=O)[O-])Br
InChI
InChI=1S/C6H4BrNO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H
InChIKey
ZDFBKZUDCQQKAC-UHFFFAOYSA-N
PubChem CID
11466

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 1-bromo-4-nitrobenzene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-bromo-4-nitrobenzene; 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