≥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.
Crystal structure of 2,6-dimethylbenzoic acid was studied by three-dimensional X-ray methods.
| Pubchem Sid | 488181669 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488181669 |
| Sourires canoniques | CC1=C(C(=CC=C1)C)C(=O)O |
| IUPAC Name | 2,6-dimethylbenzoic acid |
| InChIKey | HCBHQDKBSKYGCK-UHFFFAOYSA-N |
| INCHI | 1S/C9H10O2/c1-6-4-3-5-7(2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11) |
| Isomères SMILES | CC1=C(C(=CC=C1)C)C(=O)O |
| WGK Allemagne | 3 |
| RTECS | DG8734010 |
| Poids moléculaire | 150.17 |
| Beilstein | 1863791 |
| Reaxy-Rn | 1863791 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1863791&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 |
| Classe | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzoic acids |
| Alternative Parents | m-Xylenes Benzoyl derivatives Monocarboxylic acids and derivatives Carboxylic acids Organooxygen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzoic acid - M-xylene - Xylene - Benzoyl - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl group. |
| External Descriptors | dimethylbenzoic acid |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Article |
|---|---|---|---|
 B2224167 | Certificate of Analysis | Dec 10, 2025 | D123771 |
| B2224170 | Certificate of Analysis | Dec 10, 2025 | D123771 |
| B2224174 | Certificate of Analysis | Dec 10, 2025 | D123771 |
| B2224287 | Certificate of Analysis | Dec 10, 2025 | D123771 |
| H1608086 | Certificate of Analysis | Apr 03, 2024 | D123771 |
| A2627022 | Certificate of Analysis | Dec 13, 2023 | D123771 |
| L2322171 | Certificate of Analysis | Dec 13, 2023 | D123771 |
| L2322172 | Certificate of Analysis | Dec 13, 2023 | D123771 |
| D2303347 | Certificate of Analysis | Apr 15, 2023 | D123771 |
| F2317969 | Certificate of Analysis | Jan 03, 2022 | D123771 |
| F2317971 | Certificate of Analysis | Jan 03, 2022 | D123771 |
| F2317989 | Certificate of Analysis | Jan 03, 2022 | D123771 |
| Point d'ébullition (°C) | 160°C/17mmHg |
|---|---|
| Point de fusion (°C) | 115.0-117.0°C |
| Poids moléculaire | 150.170 g/mol |
| XLogP3 | 2.200 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 150.068 Da |
| Monoisotopic Mass | 150.068 Da |
| Topological Polar Surface Area | 37.300 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 144.000 |
| 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 |
