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Molecule record

1-ethoxy-3-nitrobenzene

C8H9NO3

167.16 g/mol

Loading structure

Molecular properties

Formula
C8H9NO3
Molar mass
167.16 g·mol−1
Exact mass
167.0582 Da
5
PubChem CID
69308

Functional groups

Alkane / alkyl carbon
Aromatic ring
Ether
Nitro compound

Physical properties

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

Common names and synonyms

  • 1-ethoxy-3-nitro-benzene
  • 210-691-2
  • 3-ETHOXYNITROBENZENE
  • 3-Nitrophenetole
  • 621-52-3
  • AI3-15391
  • AKOS015890154
  • Benzene, 1-ethoxy-3-nitro-
Show all 24 synonyms
  • CCRIS 2332
  • CS-B0032
  • DTXCID40133644
  • DTXSID40211153
  • EINECS 210-691-2
  • ETHYL 3-NITROPHENYL ETHER
  • LFOLBPDHVGDKGJ-UHFFFAOYSA-
  • MFCD00024472
  • NSC 5405
  • Phenetole, m-nitro-
  • Phenetole, m-nitro-(8CI)
  • RefChem:504500
  • SCHEMBL1985000
  • UNII-WJ7G97VX6G
  • WJ7G97VX6G
  • m-Nitrophenetole

Structure identifiers

Canonical SMILES
CCOc1cccc([N+](=O)[O-])c1
Isomeric SMILES
CCOC1=CC=CC(=C1)[N+](=O)[O-]
InChI
InChI=1S/C8H9NO3/c1-2-12-8-5-3-4-7(6-8)9(10)11/h3-6H,2H2,1H3
InChIKey
LFOLBPDHVGDKGJ-UHFFFAOYSA-N
PubChem CID
69308

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-ethoxy-3-nitrobenzene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-ethoxy-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