≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C,Argon charged,Desiccated Ships Ice chest + Ice pads 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 | CN1C2CCC1C=C(C2)C3=C(C=CS3)Br |
|---|---|
| IUPAC Name | 3-(3-bromothiophen-2-yl)-8-methyl-8-azabicyclo[3.2.1]oct-2-ene |
| InChIKey | ZJCNRVHZJADROC-UHFFFAOYSA-N |
| INCHI | 1S/C12H14BrNS/c1-14-9-2-3-10(14)7-8(6-9)12-11(13)4-5-15-12/h4-6,9-10H,2-3,7H2,1H3 |
| Isómeros SMILES | CN1C2CCC1C=C(C2)C3=C(C=CS3)Br |
| CAS alternativo | 216853-60-0 (fumarate) |
| Términos de entrada MeSH | 3-(3-bromothiophen-2-yl)-8-methyl-8-azabicyclo(3.2.1)oct-2-ene;NS3861 |
| Peso molecular | 284.22 |
| Reaxy-Rn | 24352729 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=24352729&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 | Organohalogen compounds |
| Clase | Aryl halides |
| Subclass | Aryl bromides |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Aryl bromides |
| Alternative Parents | N-alkylpyrrolidines Thiophenes Heteroaromatic compounds Trialkylamines Azacyclic compounds Organobromides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | N-alkylpyrrolidine - Aryl bromide - Heteroaromatic compound - Thiophene - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Amine - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as aryl bromides. These are organic compounds containing the acyl bromide functional group. |
| External Descriptors | Not available |
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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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 |
|---|---|---|---|
 B2402416 | Certificate of Analysis | Dec 29, 2023 | N288319 |
| B2402417 | Certificate of Analysis | Dec 29, 2023 | N288319 |
| B2402418 | Certificate of Analysis | Dec 29, 2023 | N288319 |
| B2402419 | Certificate of Analysis | Dec 29, 2023 | N288319 |
| B2402437 | Certificate of Analysis | Dec 29, 2023 | N288319 |
| B2402438 | Certificate of Analysis | Dec 29, 2023 | N288319 |
| B2402439 | Certificate of Analysis | Dec 29, 2023 | N288319 |
| B2402440 | Certificate of Analysis | Dec 29, 2023 | N288319 |
| B2402441 | Certificate of Analysis | Dec 29, 2023 | N288319 |
| B2402442 | Certificate of Analysis | Dec 29, 2023 | N288319 |
| Solubilidad | Solvent:water, Max Conc. mg/mL: 20.01, Max Conc. mM: 50; Solvent:DMSO, Max Conc. mg/mL: 40.03, Max Conc. mM: 100 |
|---|---|
| Sensibilidad | Moisture sensitive;light sensitive |
| Peso molecular | 284.220 g/mol |
| XLogP3 | 3.100 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 283.003 Da |
| Monoisotopic Mass | 283.003 Da |
| Topological Polar Surface Area | 31.500 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 291.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
