≥98% 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 | 488185613 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488185613 |
| Sonrisas canónicas | CC(=O)C(C(C(=O)C)C(=O)C)C(=O)C |
| IUPAC Name | 3,4-diacetylhexane-2,5-dione |
| InChIKey | CSKRBHOAJUMOKJ-UHFFFAOYSA-N |
| INCHI | 1S/C10H14O4/c1-5(11)9(6(2)12)10(7(3)13)8(4)14/h9-10H,1-4H3 |
| Isómeros SMILES | CC(=O)C(C(C(=O)C)C(=O)C)C(=O)C |
| Peso molecular | 198.22 |
| Reaxy-Rn | 1211267 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1211267&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 |
| Clase | Organooxygen compounds |
| Subclass | Carbonyl compounds |
| Intermediate Tree Nodes | 1,3-dicarbonyl compounds |
| Direct Parent | Beta-diketones |
| Alternative Parents | Ketones Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | 1,3-diketone - Ketone - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as beta-diketones. These are organic compounds containing two keto groups separated by a single carbon atom. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
 F2207222 | Certificate of Analysis | Mar 11, 2026 | D154241 |
| F2207234 | Certificate of Analysis | Mar 11, 2026 | D154241 |
| F2207240 | Certificate of Analysis | Mar 11, 2026 | D154241 |
| G2131184 | Certificate of Analysis | May 12, 2025 | D154241 |
| G2131185 | Certificate of Analysis | May 12, 2025 | D154241 |
| G2131186 | Certificate of Analysis | May 12, 2025 | D154241 |
| F2306089 | Certificate of Analysis | Feb 28, 2022 | D154241 |
| F2326084 | Certificate of Analysis | Feb 28, 2022 | D154241 |
| Punto de ebullición (°C) | 122°C/18mmHg(lit.) |
|---|---|
| Punto de fusión (°C) | 193 °C |
| Peso molecular | 198.220 g/mol |
| XLogP3 | -0.600 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 198.089 Da |
| Monoisotopic Mass | 198.089 Da |
| Topological Polar Surface Area | 68.300 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 232.000 |
| 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 |
