≥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.
| Pubchem Sid | 488186031 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488186031 |
| Sonrisas canónicas | CC1=C(C=CC=C1Cl)C(=O)O |
| IUPAC Name | 3-chloro-2-methylbenzoic acid |
| InChIKey | HXGHMCLCSPQMOR-UHFFFAOYSA-N |
| INCHI | 1S/C8H7ClO2/c1-5-6(8(10)11)3-2-4-7(5)9/h2-4H,1H3,(H,10,11) |
| Isómeros SMILES | CC1=C(C=CC=C1Cl)C(=O)O |
| WGK Alemania | 3 |
| RTECS | XU1645000 |
| Peso molecular | 170.59 |
| Beilstein | 9(4)1705 |
| Reaxy-Rn | 1072826 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1072826&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 |
| Clase | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Halobenzoic acids and derivatives |
| Direct Parent | Halobenzoic acids |
| Alternative Parents | 3-halobenzoic acids Benzoic acids Benzoyl derivatives Toluenes Chlorobenzenes Aryl chlorides Monocarboxylic acids and derivatives Carboxylic acids Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Halobenzoic acid - 3-halobenzoic acid - 3-halobenzoic acid or derivatives - Benzoic acid - Benzoyl - Toluene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Organic oxide - Aromatic homomonocyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as halobenzoic acids. These are benzoic acids carrying a halogen atom on the benzene ring. |
| 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 |
|---|---|---|---|
 H1419061 | Certificate of Analysis | Mar 20, 2026 | C123494 |
| F2208174 | Certificate of Analysis | Mar 11, 2026 | C123494 |
| F2208175 | Certificate of Analysis | Mar 11, 2026 | C123494 |
| E1423066 | Certificate of Analysis | Jan 05, 2026 | C123494 |
| K1702140 | Certificate of Analysis | Jun 12, 2025 | C123494 |
| F2419137 | Certificate of Analysis | Apr 15, 2024 | C123494 |
| F2419138 | Certificate of Analysis | Apr 15, 2024 | C123494 |
| E2421095 | Certificate of Analysis | Apr 15, 2024 | C123494 |
| E2421483 | Certificate of Analysis | Apr 15, 2024 | C123494 |
| C2328885 | Certificate of Analysis | Apr 10, 2023 | C123494 |
| C2328039 | Certificate of Analysis | Apr 08, 2023 | C123494 |
| C2328958 | Certificate of Analysis | Mar 24, 2022 | C123494 |
| Solubilidad | Soluble in Methanol |
|---|---|
| Punto de fusión (°C) | 163-166°C |
| Peso molecular | 170.590 g/mol |
| XLogP3 | 2.400 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 170.013 Da |
| Monoisotopic Mass | 170.013 Da |
| Topological Polar Surface Area | 37.300 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 158.000 |
| 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 |
