≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488194566 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488194566 |
| Canonical Smiles | CCCC1CC(=CC(=O)C1)C |
| IUPAC Name | 3-methyl-5-propylcyclohex-2-en-1-one |
| InChIKey | URQMEZRQHLCJKR-UHFFFAOYSA-N |
| INCHI | 1S/C10H16O/c1-3-4-9-5-8(2)6-10(11)7-9/h6,9H,3-5,7H2,1-2H3 |
| Isomeric SMILES | CCCC1CC(=CC(=O)C1)C |
| Molecular Weight | 152.24 |
| Reaxy-Rn | 1931222 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1931222&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 - Cyclic ketones |
| Direct Parent | Cyclohexenones |
| Alternative Parents | Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic homomonocyclic compounds |
| Substituents | Cyclohexenone - Organic oxide - Hydrocarbon derivative - Aliphatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond. |
| 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 |
|---|---|---|---|
 C2505171 | Certificate of Analysis | Dec 31, 2025 | C347469 |
| L2522108 | Certificate of Analysis | Dec 31, 2025 | C347469 |
| A2329103 | Certificate of Analysis | Nov 06, 2025 | C347469 |
| A2316065 | Certificate of Analysis | Oct 14, 2025 | C347469 |
| K2217541 | Certificate of Analysis | Sep 11, 2025 | C347469 |
| K2217506 | Certificate of Analysis | Sep 11, 2025 | C347469 |
| K2217505 | Certificate of Analysis | Sep 11, 2025 | C347469 |
| K2217504 | Certificate of Analysis | Sep 11, 2025 | C347469 |
| K2217494 | Certificate of Analysis | Sep 11, 2025 | C347469 |
| K2217488 | Certificate of Analysis | Sep 11, 2025 | C347469 |
| Boil Point(°C) | 242-244° C |
|---|---|
| Molecular Weight | 152.230 g/mol |
| XLogP3 | 2.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 152.12 Da |
| Monoisotopic Mass | 152.12 Da |
| Topological Polar Surface Area | 17.100 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 179.000 |
| 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 |
