≥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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488195348 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488195348 |
| Sonrisas canónicas | CC=C(C)C(=O)OC |
| IUPAC Name | methyl (E)-2-methylbut-2-enoate |
| InChIKey | YYJWBYNQJLBIGS-SNAWJCMRSA-N |
| INCHI | 1S/C6H10O2/c1-4-5(2)6(7)8-3/h4H,1-3H3/b5-4+ |
| Isómeros SMILES | C/C=C(\C)/C(=O)OC |
| RTECS | EM9254600 |
| Peso molecular | 114.14 |
| Reaxy-Rn | 1741597 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1741597&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 | Methyl esters Enoate esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Fatty acid ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl 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 |
| 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 |
|---|---|---|---|
 E2615032 | Certificate of Analysis | May 21, 2026 | M158196 |
| H2303928 | Certificate of Analysis | May 12, 2025 | M158196 |
| H2303929 | Certificate of Analysis | May 12, 2025 | M158196 |
| H2303930 | Certificate of Analysis | May 12, 2025 | M158196 |
| H2303931 | Certificate of Analysis | May 12, 2025 | M158196 |
| H2303932 | Certificate of Analysis | May 12, 2025 | M158196 |
| H2303933 | Certificate of Analysis | May 12, 2025 | M158196 |
| H2303934 | Certificate of Analysis | May 12, 2025 | M158196 |
| H2303935 | Certificate of Analysis | May 12, 2025 | M158196 |
| G2528288 | Certificate of Analysis | Jul 05, 2024 | M158196 |
| G2528299 | Certificate of Analysis | Jul 05, 2024 | M158196 |
| G2103119 | Certificate of Analysis | Apr 14, 2023 | M158196 |
| G2103116 | Certificate of Analysis | Apr 14, 2023 | M158196 |
| G2103117 | Certificate of Analysis | Apr 14, 2023 | M158196 |
| G2103118 | Certificate of Analysis | Apr 14, 2023 | M158196 |
| Índice de refracción | 1.437 |
|---|---|
| Punto de inflamación (°F) | 39 ℃ |
| Punto de inflamación (°C) | 39 ℃ |
| Punto de ebullición (°C) | 139°C |
| Peso molecular | 114.140 g/mol |
| XLogP3 | 1.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 114.068 Da |
| Monoisotopic Mass | 114.068 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 114.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 1 |
| Covalently-Bonded Unit Count | 1 |
| 1. Xiaoying Li, Chunsheng Liu, Junkai Wu, Kai Su, Xiao Xiao, Libin Zhang, B. Loye Eberhart, Caixia Chen, Fuhang Song. (2025) Comprehensive investigation on the dynamic changes of volatile organic compounds in three peach cultivars during fruit development. FOOD RESEARCH INTERNATIONAL, [PMID:40022387] [10.1016/j.foodres.2025.115866] |
