≥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.
2-Acetoxy-3-butanone occurs naturally in paw paw fruit. It is also reported to be formed by the reaction between cysteine and 2,5-dimethyl-4-hydroxy-3(2H)-furanone.
| Pubchem Sid | 488190098 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488190098 |
| Canonical Smiles | CC(C(=O)C)OC(=O)C |
| IUPAC Name | 3-oxobutan-2-yl acetate |
| InChIKey | ZKPTYCJWRHHBOW-UHFFFAOYSA-N |
| INCHI | 1S/C6H10O3/c1-4(7)5(2)9-6(3)8/h5H,1-3H3 |
| Isomeric SMILES | CC(C(=O)C)OC(=O)C |
| Molecular Weight | 130.14 |
| Reaxy-Rn | 1722439 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1722439&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 | Alpha-acyloxy carbonyl compounds |
| Direct Parent | Alpha-acyloxy ketones |
| Alternative Parents | Ketones Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Alpha-acyloxy ketone - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as alpha-acyloxy ketones. These are ketones that have an acyloxy substituent alpha to the carbonyl group. They have the general structure R4C(=O)OC(R2)(R3)C(R1)=O (R1=organyl, R4=H or organyl; R2,R3 = any 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 | Date | Item |
|---|---|---|---|
 L1612030 | Certificate of Analysis | Jul 10, 2024 | A102527 |
| C2314548 | Certificate of Analysis | Jan 13, 2023 | A102527 |
| C2314571 | Certificate of Analysis | Jan 13, 2023 | A102527 |
| C2314574 | Certificate of Analysis | Jan 13, 2023 | A102527 |
| C2314577 | Certificate of Analysis | Jan 13, 2023 | A102527 |
| C2314588 | Certificate of Analysis | Jan 13, 2023 | A102527 |
| Refractive Index | 1.4135 |
|---|---|
| Flash Point(°F) | 150.8 °F |
| Flash Point(°C) | 66°C |
| Boil Point(°C) | 154-155°C |
| Molecular Weight | 130.139 g/mol |
| XLogP3 | 0.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 130.063 Da |
| Monoisotopic Mass | 130.063 Da |
| Topological Polar Surface Area | 43.400 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 128.000 |
| 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 |
