≥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.
| Pubchem Sid | 488192779 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488192779 |
| Canonical Smiles | C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)CC(=O)O |
| IUPAC Name | 2-[2,4-bis(trifluoromethyl)phenyl]acetic acid |
| InChIKey | BCHGLBXVODTIEE-UHFFFAOYSA-N |
| INCHI | 1S/C10H6F6O2/c11-9(12,13)6-2-1-5(3-8(17)18)7(4-6)10(14,15)16/h1-2,4H,3H2,(H,17,18) |
| Isomeric SMILES | C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)CC(=O)O |
| Molecular Weight | 272.15 |
| Reaxy-Rn | 7818707 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7818707&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 | Trifluoromethylbenzenes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Trifluoromethylbenzenes |
| Alternative Parents | Monocarboxylic acids and derivatives Carboxylic acids Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Trifluoromethylbenzene - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups. |
| 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 |
|---|---|---|---|
 H2501221 | Certificate of Analysis | Jul 21, 2025 | B122842 |
| H2501222 | Certificate of Analysis | Jul 21, 2025 | B122842 |
| E2420156 | Certificate of Analysis | Apr 23, 2024 | B122842 |
| E2420531 | Certificate of Analysis | Apr 23, 2024 | B122842 |
| E2420541 | Certificate of Analysis | Apr 23, 2024 | B122842 |
| G2312184 | Certificate of Analysis | Jun 14, 2023 | B122842 |
| G2312185 | Certificate of Analysis | Jun 14, 2023 | B122842 |
| G2312188 | Certificate of Analysis | Jun 14, 2023 | B122842 |
| G2312189 | Certificate of Analysis | Jun 14, 2023 | B122842 |
| G2312191 | Certificate of Analysis | Jun 14, 2023 | B122842 |
| G2312192 | Certificate of Analysis | Jun 14, 2023 | B122842 |
| G2312197 | Certificate of Analysis | Jun 14, 2023 | B122842 |
| G2312200 | Certificate of Analysis | Jun 14, 2023 | B122842 |
| Melt Point(°C) | 85-90°C |
|---|---|
| Molecular Weight | 272.140 g/mol |
| XLogP3 | 3.200 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 2 |
| Exact Mass | 272.027 Da |
| Monoisotopic Mass | 272.027 Da |
| Topological Polar Surface Area | 37.300 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 308.000 |
| 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 |
