Determine the necessary mass, volume, or concentration for preparing a solution.
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Moligand™, ≥98% Moligand™ 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 3 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Riluzole is a drug used to treat amyotrophic lateral sclerosis.
| ALogP | 3.6 |
|---|
| Pubchem Sid | 488179874 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488179874 |
| Sonrisas canónicas | C1=CC2=C(C=C1OC(F)(F)F)SC(=N2)N |
| IUPAC Name | 6-(trifluoromethoxy)-1,3-benzothiazol-2-amine |
| InChIKey | FTALBRSUTCGOEG-UHFFFAOYSA-N |
| INCHI | 1S/C8H5F3N2OS/c9-8(10,11)14-4-1-2-5-6(3-4)15-7(12)13-5/h1-3H,(H2,12,13) |
| Isómeros SMILES | C1=CC2=C(C=C1OC(F)(F)F)SC(=N2)N |
| WGK Alemania | 3 |
| RTECS | DL2830000 |
| PubChem CID | 5070 |
| Peso molecular | 234.2 |
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 | Organoheterocyclic compounds |
| Clase | Benzothiazoles |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzothiazoles |
| Alternative Parents | Benzenoids 2-amino-1,3-thiazoles Heteroaromatic compounds Trihalomethanes Azacyclic compounds Primary amines Organopnictogen compounds Organooxygen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | 1,3-benzothiazole - Benzenoid - 1,3-thiazol-2-amine - Azole - Thiazole - Heteroaromatic compound - Trihalomethane - Azacycle - Amine - Organopnictogen compound - Organic oxygen compound - Alkyl halide - Primary amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Alkyl fluoride - Hydrocarbon derivative - Halomethane - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom). |
| External Descriptors | benzothiazoles |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
| Certificate of Analysis | Jul 07, 2026 | R129533 | |
| Certificate of Analysis | Apr 03, 2026 | R129533 | |
| Certificate of Analysis | Apr 03, 2026 | R129533 | |
| Certificate of Analysis | Apr 03, 2026 | R129533 | |
| Certificate of Analysis | Apr 03, 2026 | R129533 | |
| Certificate of Analysis | Feb 11, 2025 | R129533 | |
| Certificate of Analysis | Oct 10, 2024 | R129533 | |
| Certificate of Analysis | Oct 10, 2024 | R129533 | |
| Certificate of Analysis | Oct 10, 2024 | R129533 | |
| Certificate of Analysis | May 08, 2024 | R129533 |
| Solubilidad | DMSO 47 mg/mL Water Ethanol 47 mg/mL |
|---|---|
| Punto de fusión (°C) | 118 °C |
| Peso molecular | 234.200 g/mol |
| XLogP3 | 3.600 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 1 |
| Exact Mass | 234.007 Da |
| Monoisotopic Mass | 234.007 Da |
| Topological Polar Surface Area | 76.400 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 238.000 |
| 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 |
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