≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships FedEx DG Service Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 4 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Product Application
4-Methylcyclohexanone was used in the synthesis of the pinguisane-type sesquiterpenoid acutifolone A, in racemic form. It is used as intermediates of CCNU and it can be also be used as a solvent.
| Pubchem Sid | 488181371 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488181371 |
| Canonical Smiles | CC1CCC(=O)CC1 |
| IUPAC Name | 4-methylcyclohexan-1-one |
| InChIKey | VGVHNLRUAMRIEW-UHFFFAOYSA-N |
| INCHI | 1S/C7H12O/c1-6-2-4-7(8)5-3-6/h6H,2-5H2,1H3 |
| Isomeric SMILES | CC1CCC(=O)CC1 |
| WGK Germany | 1 |
| RTECS | GW1750200 |
| UN Number | 2297 |
| Molecular Weight | 112.17 |
| Beilstein | 506746 |
| Reaxy-Rn | 506746 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506746&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic oxygen compounds |
| Class | Organooxygen compounds |
| Subclass | Carbonyl compounds |
| Intermediate Tree Nodes | Ketones |
| Direct Parent | Cyclic ketones |
| Alternative Parents | Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic homomonocyclic compounds |
| Substituents | Cyclic ketone - Organic oxide - Hydrocarbon derivative - Aliphatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as cyclic ketones. These are organic compounds containing a ketone that is conjugated to a cyclic moiety. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 K1714100 | Certificate of Analysis | Jun 16, 2025 | M106719 |
| H2110207 | Certificate of Analysis | May 12, 2025 | M106719 |
| H2110277 | Certificate of Analysis | May 12, 2025 | M106719 |
| H2110276 | Certificate of Analysis | May 12, 2025 | M106719 |
| H2110226 | Certificate of Analysis | May 12, 2025 | M106719 |
| D2429315 | Certificate of Analysis | Mar 20, 2024 | M106719 |
| D2429314 | Certificate of Analysis | Mar 20, 2024 | M106719 |
| D2429313 | Certificate of Analysis | Mar 20, 2024 | M106719 |
| H1919023 | Certificate of Analysis | Jun 05, 2023 | M106719 |
| D2318268 | Certificate of Analysis | Apr 27, 2023 | M106719 |
| F2421064 | Certificate of Analysis | Aug 27, 2022 | M106719 |
| J22181058 | Certificate of Analysis | Aug 27, 2022 | M106719 |
| J22181067 | Certificate of Analysis | Aug 27, 2022 | M106719 |
| J22181079 | Certificate of Analysis | Aug 27, 2022 | M106719 |
| J22181080 | Certificate of Analysis | Aug 27, 2022 | M106719 |
| D2318273 | Certificate of Analysis | Aug 27, 2022 | M106719 |
| D2318281 | Certificate of Analysis | Jul 10, 2021 | M106719 |
| Solubility | Not miscible in water.Soluble in ether and alcohol |
|---|---|
| Refractive Index | 1.4443 |
| Flash Point(°F) | 118.4 °F |
| Flash Point(°C) | 48℃ |
| Boil Point(°C) | 169-171°C |
| Melt Point(°C) | -41℃ |
| Molecular Weight | 112.170 g/mol |
| XLogP3 | 1.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 112.089 Da |
| Monoisotopic Mass | 112.089 Da |
| Topological Polar Surface Area | 17.100 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 86.600 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Zhaochuang Wang, Qiaohui Lu, Xiaoyu Li, Yan Zhou, Yan Xiao, Meidong Lang. (2023) Digital light processing of customized elastic scaffolds by efficient thiol-yne crosslinking. EUROPEAN POLYMER JOURNAL, [PMID:] [10.1016/j.eurpolymj.2023.112586] |
| 2. Yue Jiang, Xiaolan Ji, Yueyang Zhang, Xiaoyu Pan, Yizhou Yang, Yiming Li, Wenhui Guo, Yong Wang, Zhiqing Ma, Bin Lei, He Yan, Xili Liu. (2022) Citral induces plant systemic acquired resistance against tobacco mosaic virus and plant fungal diseases. INDUSTRIAL CROPS AND PRODUCTS, [PMID:] [10.1016/j.indcrop.2022.114948] |
| 3. Haoran Yuan, Zejie Zhu, Lingyao Wang, Jia Yao, Haoran Li. (2024) A cooperation of ceric ammonium nitrate and N-hydroxyphthalimide in the aerobic oxidation from ketones to lactones/esters: Catalytic characterization and mechanistic investigation. JOURNAL OF MOLECULAR STRUCTURE, [PMID:] [10.1016/j.molstruc.2024.139973] |
| 4. Chengkun Bai, Bingdi Wang, Chunying Lv, Zhengshun Jiang, Guolong Lu, Hang Sun, Zhenning Liu, Song Liang. (2025) Bioinspired Photoenzymatic Cross-Membrane Cascade Catalytic System. ACS Sustainable Chemistry & Engineering, [PMID:] [10.1021/acssuschemeng.4c07762] |
