≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C Ships Wet ice 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.
Description
Diethyltert-butylmalonate has been used in the preparation of enantiomers of 4-tert-butyl-3-isopropyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane 1-sulfide (TBIPPS).
| Pubchem Sid | 504754441 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504754441 |
| Sonrisas canónicas | CCOC(=O)C(C(=O)OCC)C(C)(C)C |
| IUPAC Name | diethyl 2-tert-butylpropanedioate |
| InChIKey | RJNICNBRGVKNSR-UHFFFAOYSA-N |
| INCHI | 1S/C11H20O4/c1-6-14-9(12)8(11(3,4)5)10(13)15-7-2/h8H,6-7H2,1-5H3 |
| Isómeros SMILES | CCOC(=O)C(C(=O)OCC)C(C)(C)C |
| Peso molecular | 216.27 |
| Beilstein | 1781709 |
| Reaxy-Rn | 1781709 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1781709&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 1,3-dicarbonyl compounds Carboxylic acid esters Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Fatty acid ester - 1,3-dicarbonyl compound - 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 |
|---|---|---|---|
 H2303702 | Certificate of Analysis | May 11, 2026 | D468195 |
| H2303704 | Certificate of Analysis | May 11, 2026 | D468195 |
| H2303722 | Certificate of Analysis | May 11, 2026 | D468195 |
| H2303729 | Certificate of Analysis | May 11, 2026 | D468195 |
| H2303750 | Certificate of Analysis | May 11, 2026 | D468195 |
| F2511259 | Certificate of Analysis | May 30, 2025 | D468195 |
| F2511315 | Certificate of Analysis | May 30, 2025 | D468195 |
| F2511316 | Certificate of Analysis | May 30, 2025 | D468195 |
| H2303701 | Certificate of Analysis | Jul 14, 2023 | D468195 |
| H2303736 | Certificate of Analysis | Jul 14, 2023 | D468195 |
| H2303739 | Certificate of Analysis | Jul 14, 2023 | D468195 |
| Solubilidad | Immiscible with water. |
|---|---|
| Sensibilidad | heat sensitive |
| Índice de refracción | n20/D 1.425 (lit.) |
| Punto de inflamación (°F) | 199.4 °F - closed cup |
| Punto de inflamación (°C) | 93 °C - closed cup |
| Punto de ebullición (°C) | 102-104℃/11mmHg (lit.) |
| Peso molecular | 216.270 g/mol |
| XLogP3 | 2.600 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 7 |
| Exact Mass | 216.136 Da |
| Monoisotopic Mass | 216.136 Da |
| Topological Polar Surface Area | 52.600 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 209.000 |
| 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 |
