≥85% 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 5 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504752467 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504752467 |
| Canonical Smiles | CCCCCCCCCCCCCCCCCCCCCC(=O)OC |
| IUPAC Name | methyl docosanoate |
| InChIKey | QSQLTHHMFHEFIY-UHFFFAOYSA-N |
| INCHI | 1S/C23H46O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h3-22H2,1-2H3 |
| Isomeric SMILES | CCCCCCCCCCCCCCCCCCCCCC(=O)OC |
| WGK Germany | 1 |
| Molecular Weight | 354.61 |
| Beilstein | 1795150 |
| Reaxy-Rn | 1795147 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1795147&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 |
| Class | Fatty Acyls |
| Subclass | Fatty acid esters |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Fatty acid methyl esters |
| Alternative Parents | Methyl esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Fatty acid methyl 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 |
| Description | This compound belongs to the class of organic compounds known as fatty acid methyl esters. These are compounds containing a fatty acid that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=fatty aliphatic tail or organyl group and R'=methyl group. |
| 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 | Item |
|---|---|---|---|
 I2503026 | Certificate of Analysis | Mar 09, 2026 | M107376 |
| L2524167 | Certificate of Analysis | Mar 09, 2026 | M107376 |
| D1710020 | Certificate of Analysis | Dec 16, 2024 | M107376 |
| D2220086 | Certificate of Analysis | Nov 26, 2021 | M107376 |
| D2220096 | Certificate of Analysis | Nov 26, 2021 | M107376 |
| D2220098 | Certificate of Analysis | Nov 26, 2021 | M107376 |
| D2220101 | Certificate of Analysis | Nov 26, 2021 | M107376 |
| Flash Point(°F) | >235.4 °F |
|---|---|
| Flash Point(°C) | >113 °C |
| Boil Point(°C) | 393°C |
| Melt Point(°C) | 54-56°C |
| Molecular Weight | 354.600 g/mol |
| XLogP3 | 11.200 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 21 |
| Exact Mass | 354.35 Da |
| Monoisotopic Mass | 354.35 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 263.000 |
| 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. Shizhuang Weng, Zhaojie Chu, Manqin Wang, Kaixuan Han, Gongqin Zhu, Cunchuan Liu, Xinhua Li, Linsheng Huang. (2021) Reflectance spectroscopy with operator difference for determination of behenic acid in edible vegetable oils by using convolutional neural network and polynomial correction. FOOD CHEMISTRY, [PMID:34343814] [10.1016/j.foodchem.2021.130668] |
| 2. Ijaz Hira, Sun Shangde. (2024) Enzymatic synthesis of novel structured lipids with tiger nut oil: optimized by response surface methodology. Biomass Conversion and Biorefinery, [PMID:] [10.1007/s13399-024-06053-8] |
| 3. Xi Liu, Delong Hou, Demeng Liu, Siyu Pan, Jun Yan, Qi Zeng, Yi Chen. (2025) α-Methyl Esterification of Natural Fatty Acid Methyl Esters Directly with CO2. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, [PMID:] [10.1021/acs.iecr.5c02568] |
| 4. Hira Ijaz, Shangde Sun, Gholamreza Abdi, Rana Muhammad Aadil. (2025) Production of one novel low-calorie structured lipid using tiger nut oil by enzymatic transesterification. Applied Food Research, [PMID:] [10.1016/j.afres.2025.100944] |
| 5. Jinghan Cui, Wenjie Yu, Qifang Sun, Qiuning Wang, Jinwang Li, Xiali Guo, Yanling Song, Yan Li, Liping Luo. (2025) Response of quality differences of winter wheat from different origins to meteorological factors based on metabolomics. FOOD CHEMISTRY, [PMID:41391413] [10.1016/j.foodchem.2025.147539] |
