Molecular properties
- Formula
- C6H9NO3
- Molar mass
- 143.14 g·mol−1
- Exact mass
- 143.0582 Da
- 3
- PubChem CID
- 521241
Molecule record
2-nitrocyclohexan-1-one
C6H9NO3
143.14 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Ketone
Nitro compound
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- .alpha.-Nitrocyclohexanone
- 2-Nitrocyclohexanone
- 2-Nitrocyclohexanone, 99%
- 2-nitro-cyclohexan-1-one
- 4883-67-4
- AKOS005137917
- AT32660
- BS-22944
Show all 19 synonyms
- CS-0214598
- Cyclohexanone, 2-nitro-
- DTXCID60285679
- DTXSID50334589
- EAA88367
- EN300-182603
- F639512
- MFCD00001627
- RefChem:477201
- SCHEMBL2159399
- nitrocyclohexanone
Structure identifiers
- Canonical SMILES
- O=C1CCCCC1[N+](=O)[O-]
- Isomeric SMILES
- C1CCC(=O)C(C1)[N+](=O)[O-]
- InChI
- InChI=1S/C6H9NO3/c8-6-4-2-1-3-5(6)7(9)10/h5H,1-4H2
- InChIKey
- SZNILIWUUKKNPE-UHFFFAOYSA-N
- PubChem CID
- 521241
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 2-nitrocyclohexan-1-one; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-nitrocyclohexan-1-one; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.