≥98% 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.
product description：
α2-Chloroisodurene and mesitylacetonitrile are formed as intermediates during the synthesis of mesitylacetic acid. Mesitylacetic acid can be synthesized from mesitylene.
application：
Mesitylacetic acid may be used to synthesize 2,4,6-trimethvlbenzyl mesitylacetate.
| Pubchem Sid | 488185514 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488185514 |
| Canonical Smiles | CC1=CC(=C(C(=C1)C)CC(=O)O)C |
| IUPAC Name | 2-(2,4,6-trimethylphenyl)acetic acid |
| InChIKey | CQWMQAKKAHTCSC-UHFFFAOYSA-N |
| INCHI | 1S/C11H14O2/c1-7-4-8(2)10(6-11(12)13)9(3)5-7/h4-5H,6H2,1-3H3,(H,12,13) |
| Isomeric SMILES | CC1=CC(=C(C(=C1)C)CC(=O)O)C |
| WGK Germany | 3 |
| Molecular Weight | 178.23 |
| Beilstein | 2209880 |
| Reaxy-Rn | 2209880 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2209880&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 | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzene and substituted derivatives |
| Alternative Parents | Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Monocyclic benzene moiety - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene. |
| 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 |
|---|---|---|---|
 D1823091 | Certificate of Analysis | Nov 10, 2025 | M122899 |
| D1823090 | Certificate of Analysis | Nov 10, 2025 | M122899 |
| H1514085 | Certificate of Analysis | Apr 12, 2023 | M122899 |
| B2310779 | Certificate of Analysis | Sep 22, 2022 | M122899 |
| B2310780 | Certificate of Analysis | Sep 22, 2022 | M122899 |
| B2310825 | Certificate of Analysis | Sep 22, 2022 | M122899 |
| B2310874 | Certificate of Analysis | Sep 22, 2022 | M122899 |
| B2310906 | Certificate of Analysis | Sep 22, 2022 | M122899 |
| B2310916 | Certificate of Analysis | Sep 22, 2022 | M122899 |
| B2310924 | Certificate of Analysis | Sep 22, 2022 | M122899 |
| Melt Point(°C) | 170°C |
|---|---|
| Molecular Weight | 178.230 g/mol |
| XLogP3 | 2.500 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 178.099 Da |
| Monoisotopic Mass | 178.099 Da |
| Topological Polar Surface Area | 37.300 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 177.000 |
| 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 |
