Molecular properties
- Formula
- C8H7NO3
- Molar mass
- 165.15 g·mol−1
- Exact mass
- 165.0426 Da
- 6
- PubChem CID
- 8494
Molecule record
1-(3-nitrophenyl)ethanone
C8H7NO3
165.15 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Ketone
Nitro compound
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- (3-Nitrophenyl) methyl ketone
- 1-(3-nitrophenyl)-ethanone
- 1-Acetyl-3-nitrobenzene
- 121-89-1
- 3'-Nitroacetophenone
- 3-Nitroacetofenon
- 3-Nitroacetofenon [Czech]
- 3Nitroacetofenon
Show all 24 synonyms
- 3Nitroacetophenone
- AI3-02242
- Acetophenone, 3'-nitro-
- CCRIS 2330
- DTXCID305722
- DTXSID1025722
- EINECS 204-504-3
- Ethanone, 1-(3-nitrophenyl)-
- HSDB 2710
- M-NITROACETOPHENONE
- M-NITROACETOPHENONE [HSDB]
- Methyl 3-nitrophenyl ketone
- NSC 5511
- SU4B5T763F
- USAF MA-1
- m-Acetylnitrobenzene
Structure identifiers
- Canonical SMILES
- CC(=O)c1cccc([N+](=O)[O-])c1
- Isomeric SMILES
- CC(=O)C1=CC(=CC=C1)[N+](=O)[O-]
- InChI
- InChI=1S/C8H7NO3/c1-6(10)7-3-2-4-8(5-7)9(11)12/h2-5H,1H3
- InChIKey
- ARKIFHPFTHVKDT-UHFFFAOYSA-N
- PubChem CID
- 8494
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 1-(3-nitrophenyl)ethanone; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1-(3-nitrophenyl)ethanone; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.