Molecule record

1-ethyl-4-nitrobenzene

C8H9NO2

151.16 g/mol

Loading structure

Molecular properties

Formula
C8H9NO2
Molar mass
151.16 g·mol−1
Exact mass
151.0633 Da
5
PubChem CID
7480

Functional groups

Alkane / alkyl carbon
Aromatic ring
Nitro compound

Physical properties

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

Common names and synonyms

  • 1-ethyl-4-nitro-benzene
  • 100-12-9
  • 1Ethyl4nitrobenzene
  • 202-821-1
  • 4-ETHYLNITROBENZENE
  • 4-Nitroethylbenzene
  • 4-ethyl-1-nitrobenzene
  • Benzene, 1-ethyl-4-nitro-
Show all 24 synonyms
  • Benzene, 1ethyl4nitro
  • CCRIS 3100
  • DTXCID5032446
  • DTXSID9059206
  • EINECS 202-821-1
  • InChI=1/C8H9NO2/c1-2-7-3-5-8(6-4-7)9(10)11/h3-6H,2H2,1H
  • NSC 858
  • RESTWAHJFMZUIZ-UHFFFAOYSA-N
  • RefChem:98905
  • p-Ethyl nitro benzene
  • p-Ethylnitrobenzene
  • p-Nitroethylbenzene
  • p-Nitrophenylethane
  • pEthylnitrobenzene
  • pNitroethylbenzene
  • pNitrophenylethane

Structure identifiers

Canonical SMILES
CCc1ccc([N+](=O)[O-])cc1
Isomeric SMILES
CCC1=CC=C(C=C1)[N+](=O)[O-]
InChI
InChI=1S/C8H9NO2/c1-2-7-3-5-8(6-4-7)9(10)11/h3-6H,2H2,1H3
InChIKey
RESTWAHJFMZUIZ-UHFFFAOYSA-N
PubChem CID
7480

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-ethyl-4-nitrobenzene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-ethyl-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