≥98%(GC) 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.
| Sonrisas canónicas | CCCCC(CCCC)(C(=O)OCC)C(=O)OCC |
|---|---|
| IUPAC Name | diethyl 2,2-dibutylpropanedioate |
| InChIKey | WHKKUUPZLWUOIW-UHFFFAOYSA-N |
| INCHI | 1S/C15H28O4/c1-5-9-11-15(12-10-6-2,13(16)18-7-3)14(17)19-8-4/h5-12H2,1-4H3 |
| Isómeros SMILES | CCCCC(CCCC)(C(=O)OCC)C(=O)OCC |
| Peso molecular | 272.39 |
| Beilstein | 2(4)2119 |
| Reaxy-Rn | 518421 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=518421&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 | Lipids and lipid-like molecules |
| Clase | Fatty Acyls |
| Subclass | Fatty acid esters |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Fatty acid esters |
| Alternative Parents | Dicarboxylic acids and derivatives Carboxylic acid esters Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Fatty acid ester - Dicarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid. |
| 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 |
|---|---|---|---|
 E2529324 | Certificate of Analysis | May 16, 2025 | D155880 |
| E2529325 | Certificate of Analysis | May 16, 2025 | D155880 |
| E2529356 | Certificate of Analysis | May 16, 2025 | D155880 |
| E2529357 | Certificate of Analysis | May 16, 2025 | D155880 |
| E2529358 | Certificate of Analysis | May 16, 2025 | D155880 |
| E2529359 | Certificate of Analysis | May 16, 2025 | D155880 |
| E2529362 | Certificate of Analysis | May 16, 2025 | D155880 |
| Índice de refracción | 1.43 |
|---|---|
| Punto de inflamación (°C) | 126 °C |
| Punto de ebullición (°C) | 142°C/8mmHg(lit.) |
| Peso molecular | 272.380 g/mol |
| XLogP3 | 4.700 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 12 |
| Exact Mass | 272.199 Da |
| Monoisotopic Mass | 272.199 Da |
| Topological Polar Surface Area | 52.600 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 245.000 |
| 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 |
