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≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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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.
| Canonical Smiles | C1=CC=C(C=C1)S(=O)(=O)N2C(=CC3=C2N=CC=C3)Br |
|---|---|
| IUPAC Name | 1-(benzenesulfonyl)-2-bromopyrrolo[2,3-b]pyridine |
| InChIKey | KOFVJNXDFFCCBB-UHFFFAOYSA-N |
| INCHI | 1S/C13H9BrN2O2S/c14-12-9-10-5-4-8-15-13(10)16(12)19(17,18)11-6-2-1-3-7-11/h1-9H |
| Isomeric SMILES | C1=CC=C(C=C1)S(=O)(=O)N2C(=CC3=C2N=CC=C3)Br |
| PubChem CID | 67466079 |
| Molecular Weight | 337.19 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →| Molecular Weight | 337.190 g/mol |
|---|---|
| XLogP3 | 3.500 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 335.957 Da |
| Monoisotopic Mass | 335.957 Da |
| Topological Polar Surface Area | 60.300 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 417.000 |
| 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 |