≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Temperatura ambiente 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 | 488190387 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488190387 |
| Sorrisos canónicos | COC(=O)C(CC=C)C(=O)OC |
| IUPAC Name | dimethyl 2-prop-2-enylpropanedioate |
| InChIKey | VZNFVLWVVHHMBG-UHFFFAOYSA-N |
| INCHI | 1S/C8H12O4/c1-4-5-6(7(9)11-2)8(10)12-3/h4,6H,1,5H2,2-3H3 |
| SMILES isoméricas | COC(=O)C(CC=C)C(=O)OC |
| WGK Alemanha | 3 |
| Peso molecular | 172.18 |
| Beilstein | 1772822 |
| Reaxy-Rn | 1772822 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1772822&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 | Dicarboxylic acids and derivatives 1,3-dicarbonyl compounds Methyl esters Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Fatty acid ester - 1,3-dicarbonyl compound - Dicarboxylic acid or derivatives - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound |
| Descrição | 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 | Data | Item |
|---|---|---|---|
 K2427401 | Certificate of Analysis | Sep 04, 2026 | D120333 |
| K2427402 | Certificate of Analysis | Sep 04, 2026 | D120333 |
| K2427403 | Certificate of Analysis | Sep 04, 2026 | D120333 |
| K2427404 | Certificate of Analysis | Sep 04, 2026 | D120333 |
| G2610134 | Certificate of Analysis | Nov 16, 2024 | D120333 |
| H1608053 | Certificate of Analysis | Dec 11, 2023 | D120333 |
| I2214578 | Certificate of Analysis | Aug 12, 2022 | D120333 |
| I2214580 | Certificate of Analysis | Aug 12, 2022 | D120333 |
| I2214581 | Certificate of Analysis | Aug 12, 2022 | D120333 |
| I2214582 | Certificate of Analysis | Aug 12, 2022 | D120333 |
| Índice de refração | 1.435 |
|---|---|
| Ponto de inflamação (°F) | 199.4 °F |
| Ponto de inflamação (°C) | 95°C(203°F) |
| Ponto de ebulição (°C) | 207°C |
| Ponto de fusão (°C) | <-80°C |
| Peso molecular | 172.180 g/mol |
| XLogP3 | 1.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 172.074 Da |
| Monoisotopic Mass | 172.074 Da |
| Topological Polar Surface Area | 52.600 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 169.000 |
| 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 |
