≥98% 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.
| Sonrisas canónicas | C1=CC(=C(C(=C1)C(F)(F)F)C#N)C(F)(F)F |
|---|---|
| IUPAC Name | 2,6-bis(trifluoromethyl)benzonitrile |
| InChIKey | ANWBHDYEEOSTSE-UHFFFAOYSA-N |
| INCHI | 1S/C9H3F6N/c10-8(11,12)6-2-1-3-7(5(6)4-16)9(13,14)15/h1-3H |
| Isómeros SMILES | C1=CC(=C(C(=C1)C(F)(F)F)C#N)C(F)(F)F |
| Peso molecular | 239.12 |
| Reaxy-Rn | 2590430 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2590430&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 | Trifluoromethylbenzenes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Trifluoromethylbenzenes |
| Alternative Parents | Benzonitriles Nitriles Organopnictogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Trifluoromethylbenzene - Benzonitrile - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound |
| Descripción | 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 | Fecha | Articulo |
|---|---|---|---|
 D2527043 | Certificate of Analysis | Oct 18, 2024 | B192353 |
| D2527044 | Certificate of Analysis | Oct 18, 2024 | B192353 |
| D2527045 | Certificate of Analysis | Oct 18, 2024 | B192353 |
| D2527046 | Certificate of Analysis | Oct 18, 2024 | B192353 |
| D2527047 | Certificate of Analysis | Oct 18, 2024 | B192353 |
| D2527048 | Certificate of Analysis | Oct 18, 2024 | B192353 |
| D2527049 | Certificate of Analysis | Oct 18, 2024 | B192353 |
| D2527050 | Certificate of Analysis | Oct 18, 2024 | B192353 |
| Peso molecular | 239.120 g/mol |
|---|---|
| XLogP3 | 3.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 0 |
| Exact Mass | 239.017 Da |
| Monoisotopic Mass | 239.017 Da |
| Topological Polar Surface Area | 23.800 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 273.000 |
| 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 |
