≥97% 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.
It is an important quinolone antibacterial intermediate.
It was used in preparation of 5-fluoro-2-methoxy-4-methylaminbenzamide.
| Pubchem Sid | 504759091 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504759091 |
| Sonrisas canónicas | C1=C(C(=CC(=C1F)F)F)C(=O)O |
| IUPAC Name | 2,4,5-trifluorobenzoic acid |
| InChIKey | AKAMNXFLKYKFOJ-UHFFFAOYSA-N |
| INCHI | 1S/C7H3F3O2/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2H,(H,11,12) |
| Isómeros SMILES | C1=C(C(=CC(=C1F)F)F)C(=O)O |
| WGK Alemania | 3 |
| PubChem CID | 521170 |
| Peso molecular | 176.09 |
| Beilstein | 3257610 |
| Reaxy-Rn | 3257609 |
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 | 4-halobenzoic acids 3-halobenzoic acids 2-halobenzoic acids Benzoic acids Benzoyl derivatives 1-carboxy-2-haloaromatic compounds Fluorobenzenes Aryl fluorides Vinylogous halides Monocarboxylic acids and derivatives Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Halobenzoic acid - 4-halobenzoic acid - 3-halobenzoic acid - 2-halobenzoic acid - 4-halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzoic acid - 1-carboxy-2-haloaromatic compound - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Vinylogous halide - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organofluoride - 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 |
|---|---|---|---|
 C2512643 | Certificate of Analysis | Sep 29, 2024 | T162540 |
| C2512644 | Certificate of Analysis | Sep 29, 2024 | T162540 |
| C2512646 | Certificate of Analysis | Sep 29, 2024 | T162540 |
| C2512653 | Certificate of Analysis | Sep 29, 2024 | T162540 |
| J2414792 | Certificate of Analysis | Jun 25, 2024 | T162540 |
| J2414793 | Certificate of Analysis | Jun 25, 2024 | T162540 |
| C2013015 | Certificate of Analysis | Jan 23, 2024 | T162540 |
| K2323105 | Certificate of Analysis | Nov 27, 2023 | T162540 |
| L2209268 | Certificate of Analysis | Dec 14, 2022 | T162540 |
| Punto de fusión (°C) | 98 °C |
|---|---|
| Peso molecular | 176.090 g/mol |
| XLogP3 | 1.700 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 176.009 Da |
| Monoisotopic Mass | 176.009 Da |
| Topological Polar Surface Area | 37.300 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 185.000 |
| 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 |
