Molecular properties
- Formula
- C8H5NO3
- Molar mass
- 163.13 g·mol−1
- Exact mass
- 163.0269 Da
- 7
- PubChem CID
- 13307979
Molecule record
4-nitro-1-benzofuran
C8H5NO3
163.13 g/mol
Loading structure
Functional groups
Aromatic ring
Nitro compound
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 4-NItrocumaron
- 4-nitrobenzofuran
- 69227-65-2
- AKOS006328743
- Benzofuran, 4-nitro-
- HOPJVUYLPKTWEF-UHFFFAOYSA-N
- MFCD09834713
- SCHEMBL16288619
Show all 11 synonyms
- SCHEMBL18936141
- SCHEMBL6364597
- SCHEMBL663238
Structure identifiers
- Canonical SMILES
- O=[N+]([O-])c1cccc2occc12
- Isomeric SMILES
- C1=CC(=C2C=COC2=C1)[N+](=O)[O-]
- InChI
- InChI=1S/C8H5NO3/c10-9(11)7-2-1-3-8-6(7)4-5-12-8/h1-5H
- InChIKey
- HOPJVUYLPKTWEF-UHFFFAOYSA-N
- PubChem CID
- 13307979
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 4-nitro-1-benzofuran; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 4-nitro-1-benzofuran; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.