≥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.
It may be used in chemical synthesis.
| Pubchem Sid | 488187844 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488187844 |
| Canonical Smiles | C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)Br |
| IUPAC Name | 1-bromo-2,4-bis(trifluoromethyl)benzene |
| InChIKey | QDEJWLIKRLJYEK-UHFFFAOYSA-N |
| INCHI | 1S/C8H3BrF6/c9-6-2-1-4(7(10,11)12)3-5(6)8(13,14)15/h1-3H |
| Isomeric SMILES | C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)Br |
| WGK Germany | 3 |
| Molecular Weight | 293 |
| Beilstein | 6208648 |
| Reaxy-Rn | 6208648 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6208648&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 | Bromobenzenes Aryl bromides Organofluorides Organobromides Hydrocarbon derivatives Alkyl fluorides |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Trifluoromethylbenzene - Halobenzene - Bromobenzene - Aryl halide - Aryl bromide - Hydrocarbon derivative - Organofluoride - Organobromide - Organohalogen compound - 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 |
|---|---|---|---|
 C1608086 | Certificate of Analysis | Oct 08, 2023 | B123759 |
| E2326191 | Certificate of Analysis | Jul 22, 2022 | B123759 |
| E2326193 | Certificate of Analysis | Jul 22, 2022 | B123759 |
| I2224029 | Certificate of Analysis | Jul 22, 2022 | B123759 |
| I2224030 | Certificate of Analysis | Jul 22, 2022 | B123759 |
| I2224089 | Certificate of Analysis | Jul 22, 2022 | B123759 |
| I2224090 | Certificate of Analysis | Jul 22, 2022 | B123759 |
| Refractive Index | 1.437 |
|---|---|
| Flash Point(°F) | 156.2 °F |
| Flash Point(°C) | 69 °C |
| Boil Point(°C) | 158°C |
| Molecular Weight | 293.000 g/mol |
| XLogP3 | 4.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 0 |
| Exact Mass | 291.932 Da |
| Monoisotopic Mass | 291.932 Da |
| Topological Polar Surface Area | 0.000 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 220.000 |
| 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 |
