≥99%(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.
| Pubchem Sid | 504755359 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504755359 |
| Sourires canoniques | CCOC(=O)CC(C)(C)C |
| IUPAC Name | ethyl 3,3-dimethylbutanoate |
| InChIKey | JWMNHAMYTBAUPI-UHFFFAOYSA-N |
| INCHI | 1S/C8H16O2/c1-5-10-7(9)6-8(2,3)4/h5-6H2,1-4H3 |
| Isomères SMILES | CCOC(=O)CC(C)(C)C |
| Poids moléculaire | 144.21 |
| Reaxy-Rn | 1749778 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1749778&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 |
| Classe | Fatty Acyls |
| Subclass | Fatty acid esters |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Fatty acid esters |
| Alternative Parents | Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Fatty acid ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound |
| Description | 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 | Date | Article |
|---|---|---|---|
 E2526212 | Certificate of Analysis | May 30, 2025 | E156145 |
| D2502241 | Certificate of Analysis | Jun 29, 2024 | E156145 |
| D2502242 | Certificate of Analysis | Jun 29, 2024 | E156145 |
| E1907005 | Certificate of Analysis | Feb 13, 2023 | E156145 |
| G2311026 | Certificate of Analysis | Feb 13, 2023 | E156145 |
| K2313010 | Certificate of Analysis | Feb 13, 2023 | E156145 |
| Indice de réfraction | 1.4 |
|---|---|
| Point d'éclair (°F) | 34°C(lit.) |
| Point d'éclair (°C) | 34°C(lit.) |
| Point d'ébullition (°C) | 145 °C |
| Poids moléculaire | 144.210 g/mol |
| XLogP3 | 2.100 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 144.115 Da |
| Monoisotopic Mass | 144.115 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 111.000 |
| 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 |
