| CAS Number | 1214372-19-6 |
| Catalog Number | AG009YUL(AGN-PC-0WCMC1) |
| Chemical Name | 3-BROMO-2-FLUOROBENZENESULFONYLCHLORIDE |
| IUPAC Name | 3-bromo-2-fluorobenzenesulfonyl chloride |
| InChI | InChI=1S/C6H3BrClFO2S/c7-4-2-1-3-5(6(4)9)12(8,10)11/h1-3H |
| InChI Key | HCIVRVSTKMVMGM-UHFFFAOYSA-N |
| MDL Number | MFCD13185362 |
| Molecular Formula | C6H3BrClFO2S |
| Molecular Weight | 273.5072 |
| SMILES | Brc1cccc(c1F)S(=O)(=O)Cl |
| Synonyms | 1214372-19-6,
3-Bromo-2-fluorobenzenesulfonylchloride,
3-Bromo-2-fluorobenzenesulfonyl chloride,
3-Bromo-2-fluorobenzene-1-sulfonyl chloride,
SCHEMBL2163749,
MFCD13185362,
ZINC100554647,
CM13630,
3-Bromo-2-fluoro-benzenesulfonyl chloride,
AS-33210,
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| Complexity | 251 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.871g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 273.5g/mol |
| Monoisotopic Mass | 271.871g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
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