≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C Ships Wet ice 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG
| Pubchem Sid | 504752034 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504752034 |
| Canonical Smiles | CC1CCCCCCCCCCCCC(=O)C1 |
| IUPAC Name | 3-methylcyclopentadecan-1-one |
| InChIKey | ALHUZKCOMYUFRB-UHFFFAOYSA-N |
| INCHI | 1S/C16H30O/c1-15-12-10-8-6-4-2-3-5-7-9-11-13-16(17)14-15/h15H,2-14H2,1H3 |
| Isomeric SMILES | CC1CCCCCCCCCCCCC(=O)C1 |
| Molecular Weight | 238.41 |
| Reaxy-Rn | 2047145 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2047145&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 |
|---|---|---|---|
 K2524539 | Certificate of Analysis | Dec 04, 2025 | M141496 |
| K2524540 | Certificate of Analysis | Dec 04, 2025 | M141496 |
| K2524555 | Certificate of Analysis | Dec 04, 2025 | M141496 |
| A2419507 | Certificate of Analysis | Oct 13, 2025 | M141496 |
| A2419509 | Certificate of Analysis | Oct 13, 2025 | M141496 |
| A2419510 | Certificate of Analysis | Oct 13, 2025 | M141496 |
| C2017130 | Certificate of Analysis | Jun 16, 2025 | M141496 |
| J2210586 | Certificate of Analysis | Oct 15, 2022 | M141496 |
| J2210587 | Certificate of Analysis | Oct 15, 2022 | M141496 |
| J2210588 | Certificate of Analysis | Oct 15, 2022 | M141496 |
| J2210589 | Certificate of Analysis | Oct 15, 2022 | M141496 |
| Solubility | Solubility in water: Practically insoluble; Very soluble in Ethanol,Acetone,Ether |
|---|---|
| Refractive Index | 1.4802 |
| Flash Point(°C) | 145 °C |
| Boil Point(°C) | 90°C |
| Melt Point(°C) | -15°C(lit.) |
| Molecular Weight | 238.410 g/mol |
| XLogP3 | 6.200 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 238.23 Da |
| Monoisotopic Mass | 238.23 Da |
| Topological Polar Surface Area | 17.100 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 198.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Chang-Seob Seo, Hyeun-Kyoo Shin. (2023) Quantitative Analysis of Eight Compounds in Traditional Korean Medicine, Gongjindan Using HPLC, UPLC–MS/MS, and GC–MS/MS Systems. Separations, 10 (4): (231). [PMID:] [10.3390/separations10040231] |
| 2. Zifan Qiao, Lihua Chen, Mubarak G. Bello, Shiyu Huang. (2025) Preparation and Characterization of Muscone Oil-Based Cyclodextrin Metal–Organic Frameworks: Molecular Dynamics Simulations and Stability Evaluation. Pharmaceutics, 17 (4): (497). [PMID:40284492] [10.3390/pharmaceutics17040497] |
