≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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 | 488198937 |
|---|---|
| Canonical Smiles | C1=CC(=C(C(=C1)F)C(F)(F)F)N |
| IUPAC Name | 3-fluoro-2-(trifluoromethyl)aniline |
| InChIKey | SJMDWKFHBPDEQT-UHFFFAOYSA-N |
| INCHI | 1S/C7H5F4N/c8-4-2-1-3-5(12)6(4)7(9,10)11/h1-3H,12H2 |
| Isomeric SMILES | C1=CC(=C(C(=C1)F)C(F)(F)F)N |
| Molecular Weight | 179.12 |
| Reaxy-Rn | 9903111 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9903111&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 | Aniline and substituted anilines Fluorobenzenes Aryl fluorides Primary amines Organofluorides Hydrocarbon derivatives Alkyl fluorides |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Trifluoromethylbenzene - Aniline or substituted anilines - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Amine - Organonitrogen compound - Primary amine - 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 |
|---|---|---|---|
 D2308142 | Certificate of Analysis | Jan 20, 2026 | F190250 |
| D2308143 | Certificate of Analysis | Jan 20, 2026 | F190250 |
| D2308147 | Certificate of Analysis | Jan 20, 2026 | F190250 |
| D2308148 | Certificate of Analysis | Jan 20, 2026 | F190250 |
| D2308152 | Certificate of Analysis | Jan 20, 2026 | F190250 |
| D2308153 | Certificate of Analysis | Jan 20, 2026 | F190250 |
| D2308154 | Certificate of Analysis | Jan 20, 2026 | F190250 |
| D2308155 | Certificate of Analysis | Jan 20, 2026 | F190250 |
| D2308164 | Certificate of Analysis | Jan 20, 2026 | F190250 |
| D2308171 | Certificate of Analysis | Jan 20, 2026 | F190250 |
| Refractive Index | 1.4695 |
|---|---|
| Molecular Weight | 179.110 g/mol |
| XLogP3 | 2.200 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 0 |
| Exact Mass | 179.036 Da |
| Monoisotopic Mass | 179.036 Da |
| Topological Polar Surface Area | 26.000 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 156.000 |
| 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 |
