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Molecule record

1-fluoro-3-nitrobenzene

C6H4FNO2

141.10 g/mol

Loading structure

Molecular properties

Formula
C6H4FNO2
Molar mass
141.10 g·mol−1
Exact mass
141.0226 Da
5
PubChem CID
9823

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-Fluoro-3-nitro-benzene
  • 1-NITRO-3-FLUOROBENZENE
  • 206-953-0
  • 3-Fluoronitrobenzene
  • 3-fluoro-1-nitrobenzene
  • 3-fluoro-nitrobenzene
  • 3-nitro-fluorobenzene
  • 3-nitrofluorobenzene
Show all 24 synonyms
  • 402-67-5
  • Afatinib Impurity Z
  • Benzene, 1-fluoro-3-nitro-
  • Benzene, 1-fluoro-3-nitro-(8CI)
  • Benzene, 1-fluoro-3-nitro-(8CI)(9CI)
  • CCK4NSJ7M3
  • DTXCID90115692
  • DTXSID20193201
  • EINECS 206-953-0
  • InChI=1/C6H4FNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4
  • MFCD00007196
  • NSC 60651
  • NSC60651
  • RefChem:432812
  • m-Fluoronitrobenzene
  • m-Nitrofluorobenzene

Structure identifiers

Canonical SMILES
O=[N+]([O-])c1cccc(F)c1
Isomeric SMILES
C1=CC(=CC(=C1)F)[N+](=O)[O-]
InChI
InChI=1S/C6H4FNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H
InChIKey
WMASLRCNNKMRFP-UHFFFAOYSA-N
PubChem CID
9823

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-fluoro-3-nitrobenzene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-fluoro-3-nitrobenzene; not experimental data.

Sources

Molecule identity

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

PubChem(link only)
Open source record