≥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 | 488188957 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488188957 |
| Canonical Smiles | CC(=O)OCC(=O)COC(=O)C |
| IUPAC Name | (3-acetyloxy-2-oxopropyl) acetate |
| InChIKey | PZVCVSQSQHGBNE-UHFFFAOYSA-N |
| INCHI | 1S/C7H10O5/c1-5(8)11-3-7(10)4-12-6(2)9/h3-4H2,1-2H3 |
| Isomeric SMILES | CC(=O)OCC(=O)COC(=O)C |
| Molecular Weight | 174.15 |
| Reaxy-Rn | 1777484 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1777484&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 | Monosaccharides Glycerone and derivatives Dicarboxylic acids and derivatives Carboxylic acid esters Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Alpha-acyloxy ketone - Glycerone or derivatives - Monosaccharide - Dicarboxylic acid or derivatives - Ketone - Carboxylic acid ester - 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 |
|---|---|---|---|
 A23311163 | Certificate of Analysis | Dec 02, 2022 | D154401 |
| A2331672 | Certificate of Analysis | Dec 02, 2022 | D154401 |
| A2331686 | Certificate of Analysis | Dec 02, 2022 | D154401 |
| A2331690 | Certificate of Analysis | Dec 02, 2022 | D154401 |
| A2331691 | Certificate of Analysis | Dec 02, 2022 | D154401 |
| A2331711 | Certificate of Analysis | Dec 02, 2022 | D154401 |
| A2331730 | Certificate of Analysis | Dec 02, 2022 | D154401 |
| Melt Point(°C) | 50 °C |
|---|---|
| Molecular Weight | 174.150 g/mol |
| XLogP3 | -0.200 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 174.053 Da |
| Monoisotopic Mass | 174.053 Da |
| Topological Polar Surface Area | 69.700 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 176.000 |
| 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 |
