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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.
3-(Trifluoromethyl)phenylacetic acid [(α,α,α-Trifluoro-m-tolyl)acetic acid] was used in the preparation of N,N-diethyl[(α,α,α-triuoro-m-tolyl)]acetamide(DM156)
| Pubchem Sid | 488183995 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488183995 |
| Canonical Smiles | C1=CC(=CC(=C1)C(F)(F)F)CC(=O)O |
| IUPAC Name | 2-[3-(trifluoromethyl)phenyl]acetic acid |
| InChIKey | BLXXCCIBGGBDHI-UHFFFAOYSA-N |
| INCHI | 1S/C9H7F3O2/c10-9(11,12)7-3-1-2-6(4-7)5-8(13)14/h1-4H,5H2,(H,13,14) |
| Isomeric SMILES | C1=CC(=CC(=C1)C(F)(F)F)CC(=O)O |
| WGK Germany | 3 |
| PubChem CID | 67695 |
| Molecular Weight | 204.15 |
| Beilstein | 2213223 |
| Reaxy-Rn | 2213223 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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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 |
|---|---|---|---|
| Certificate of Analysis | Dec 10, 2025 | T106646 | |
| Certificate of Analysis | Dec 10, 2025 | T106646 | |
| Certificate of Analysis | Dec 10, 2025 | T106646 | |
| Certificate of Analysis | Dec 10, 2025 | T106646 | |
| Certificate of Analysis | Jun 29, 2024 | T106646 | |
| Certificate of Analysis | Jun 29, 2024 | T106646 | |
| Certificate of Analysis | Aug 01, 2023 | T106646 | |
| Certificate of Analysis | Feb 10, 2022 | T106646 | |
| Certificate of Analysis | Feb 10, 2022 | T106646 | |
| Certificate of Analysis | Feb 10, 2022 | T106646 |
| Melt Point(°C) | 77-78°C |
|---|---|
| Molecular Weight | 204.150 g/mol |
| XLogP3 | 2.600 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 204.04 Da |
| Monoisotopic Mass | 204.04 Da |
| Topological Polar Surface Area | 37.300 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 213.000 |
| 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 |