Molecule record

4-nitrodibenzofuran

C12H7NO3

213.19 g/mol

Loading structure

Molecular properties

Formula
C12H7NO3
Molar mass
213.19 g·mol−1
Exact mass
213.0426 Da
10
PubChem CID
150739

Functional groups

Aromatic ring
Nitro compound

Physical properties

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

Common names and synonyms

  • 4-17-00-00591 (Beilstein Handbook Reference)
  • 4-Nitrodibenzo[b,d]furan
  • 86607-81-0
  • BRN 0186215
  • CCRIS 5087
  • CS-0456645
  • DB-113402
  • DTXCID10158187
Show all 14 synonyms
  • DTXSID80235696
  • Dibenzofuran, 4-nitro-
  • F776652
  • H60086
  • RefChem:337250
  • SCHEMBL17917509

Structure identifiers

Canonical SMILES
O=[N+]([O-])c1cccc2c1oc1ccccc12
Isomeric SMILES
C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)[N+](=O)[O-]
InChI
InChI=1S/C12H7NO3/c14-13(15)10-6-3-5-9-8-4-1-2-7-11(8)16-12(9)10/h1-7H
InChIKey
QRAVOJOOXRDMQF-UHFFFAOYSA-N
PubChem CID
150739

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-nitrodibenzofuran; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-nitrodibenzofuran; 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