≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature,Desiccated 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 8 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504756823 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504756823 |
| Sonrisas canónicas | CC(C)CCCCCOC(=O)C(=C)C |
| IUPAC Name | 6-methylheptyl 2-methylprop-2-enoate |
| InChIKey | NQSLZEHVGKWKAY-UHFFFAOYSA-N |
| INCHI | 1S/C12H22O2/c1-10(2)8-6-5-7-9-14-12(13)11(3)4/h10H,3,5-9H2,1-2,4H3 |
| Isómeros SMILES | CC(C)CCCCCOC(=O)C(=C)C |
| Peso molecular | 198.3 |
| Reaxy-Rn | 13253493 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13253493&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 | Organic acids and derivatives |
| Clase | Carboxylic acids and derivatives |
| Subclass | Carboxylic acid derivatives |
| Intermediate Tree Nodes | Carboxylic acid esters - Alpha,beta-unsaturated carboxylic esters |
| Direct Parent | Enoate esters |
| Alternative Parents | Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Enoate ester - Monocarboxylic acid or derivatives - 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 enoate esters. These are an alpha,beta-unsaturated carboxylic ester of general formula R1C(R2)=C(R3)C(=O)OR4 (R4= organyl compound) in which the ester C=O function is conjugated to a C=C double bond at the alpha,beta position. |
| 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 |
|---|---|---|---|
 I2515513 | Certificate of Analysis | Mar 20, 2025 | I303328 |
| I2515515 | Certificate of Analysis | Mar 20, 2025 | I303328 |
| I2524001 | Certificate of Analysis | Mar 20, 2025 | I303328 |
| B2226576 | Certificate of Analysis | Dec 10, 2024 | I303328 |
| B2226640 | Certificate of Analysis | Dec 10, 2024 | I303328 |
| B2226658 | Certificate of Analysis | Dec 10, 2024 | I303328 |
| A2212108 | Certificate of Analysis | Nov 07, 2024 | I303328 |
| F2429011 | Certificate of Analysis | Jun 24, 2024 | I303328 |
| F2429142 | Certificate of Analysis | Jun 24, 2024 | I303328 |
| F2123249 | Certificate of Analysis | Apr 25, 2024 | I303328 |
| F2123250 | Certificate of Analysis | Apr 25, 2024 | I303328 |
| F2123251 | Certificate of Analysis | Apr 25, 2024 | I303328 |
| B2226584 | Certificate of Analysis | Jan 07, 2022 | I303328 |
| Peso molecular | 198.300 g/mol |
|---|---|
| XLogP3 | 4.800 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 8 |
| Exact Mass | 198.162 Da |
| Monoisotopic Mass | 198.162 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 183.000 |
| 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 |
| 1. Xie Zhiyuan, Wang Dong, Yu Zhanyu, Zheng Wen, Liu Bo, Zhang Aibo. (2022) The preparation and absorbing properties of controllable porous polymer microspheres @ MWCNTs absorber with lightweight characterization. JOURNAL OF POLYMER RESEARCH, 29 (10): (1-11). [PMID:] [10.1007/s10965-022-03253-6] |
| 2. Guiqiang Fei, Huanqiong Geng, Haihua Wang, Xuan Liu, Yong Liao, Yanming Shao, Mengxi Wang. (2019) Optimization of Waterborne Poly(Urethane-Acrylate) Nanoemulsions Based on Cationic Polymerizable Macrosurfactants with Different Hydrophobic Side Chain Length. Polymers, 11 (12): (1922). [PMID:31766546] [10.3390/polym11121922] |
| 3. Wenwen Jiang, Xinyue Zhang, Yafei Luan, Rensheng Wang, Hanzhou Liu, Dan Li, Liang Hu. (2019) Using γ-Ray Polymerization-Induced Assemblies to Synthesize Polydopamine Nanocapsules. Polymers, 11 (11): (1754). [PMID:31731483] [10.3390/polym11111754] |
| 4. Ding Zhang, Ping Xing, Renming Pan, Xiangyang Lin, Min Sha, Biao Jiang. (2018) Preparation and Surface Properties Study of Novel Fluorine-Containing Methacrylate Polymers for Coating. Materials, 11 (11): (2258). [PMID:30428523] [10.3390/ma11112258] |
| 5. Weixing Xu, Jianfei Zhou, Ya’nan Wang, Bi Shi. (2016) Modification of Leather Split by In Situ Polymerization of Acrylates. International Journal of Polymer Science, [PMID:] [10.1155/2016/7460572] |
| 6. Liu Yijie, Zhang Dan, Bai Ligai, Yan Hongyuan, Liu Haiyan. (2024) Simultaneous Enrichment and Purification of Licorice Chalcone A and Isoliquiritigenin in Licorice Using a Mixed-Mode Monolith. CHROMATOGRAPHIA, [PMID:] [10.1007/s10337-024-04374-4] |
| 7. Guangran Shao, Fuyang Hu, Xiaohua Tong, Ming Yuan, Boyi Song, Wangqing Zhang. (2025) Membranes Fused from Block Copolymer Nanoassemblies: Nanoassembly Morphology Affecting the Membrane Structure. MACROMOLECULES, [PMID:] [10.1021/acs.macromol.5c01808] |
| 8. Wei Xuanwen, Guo Jiaqi, Bai Ligai, Yan Hongyuan, Liu Haiyan. (2026) Screening of anti-inflammatory parts in pine needles and their enrichment by a hydrophilic/hydrophobic diphase monolith. CHEMICAL PAPERS, [PMID:] [10.1007/s11696-026-04738-0] |
