≥97% 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488194077 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488194077 |
| Sonrisas canónicas | CC(=O)OC1=C(C=C(C=C1)Cl)C(=O)O |
| IUPAC Name | 2-acetyloxy-5-chlorobenzoic acid |
| InChIKey | CNWHHQWYXIPHGY-UHFFFAOYSA-N |
| INCHI | 1S/C9H7ClO4/c1-5(11)14-8-3-2-6(10)4-7(8)9(12)13/h2-4H,1H3,(H,12,13) |
| Isómeros SMILES | CC(=O)OC1=C(C=C(C=C1)Cl)C(=O)O |
| Peso molecular | 214.6 |
| Reaxy-Rn | 2213835 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2213835&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 | Hydroxybenzoic acid derivatives - Salicylic acid and derivatives - Acylsalicylic acids and derivatives |
| Direct Parent | Acylsalicylic acids |
| Alternative Parents | Phenol esters Halobenzoic acids 3-halobenzoic acids Benzoic acids Phenoxy compounds Benzoyl derivatives Chlorobenzenes Dicarboxylic acids and derivatives Aryl chlorides Carboxylic acid esters Carboxylic acids Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Acylsalicylic acid - Halobenzoic acid - 3-halobenzoic acid - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Phenol ester - Benzoic acid - Phenoxy compound - Benzoyl - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Carboxylic acid - Organochloride - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Aromatic homomonocyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as acylsalicylic acids. These are o-acylated derivatives of salicylic acid. |
| 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 |
|---|---|---|---|
 D23191281 | Certificate of Analysis | Feb 04, 2026 | A478749 |
| D23191342 | Certificate of Analysis | Feb 04, 2026 | A478749 |
| I2410453 | Certificate of Analysis | Aug 26, 2024 | A478749 |
| I2410460 | Certificate of Analysis | Aug 26, 2024 | A478749 |
| I2410465 | Certificate of Analysis | Aug 26, 2024 | A478749 |
| I2410466 | Certificate of Analysis | Aug 26, 2024 | A478749 |
| D23191307 | Certificate of Analysis | Mar 14, 2023 | A478749 |
| D23191347 | Certificate of Analysis | Mar 14, 2023 | A478749 |
| Peso molecular | 214.600 g/mol |
|---|---|
| XLogP3 | 1.800 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 214.003 Da |
| Monoisotopic Mass | 214.003 Da |
| Topological Polar Surface Area | 63.600 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 241.000 |
| 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 |
