| CAS Number | 1704121-60-7 |
| Catalog Number | AG00ARPM(AGN-PC-0WCTQA) |
| Chemical Name | 5-bromo-N-cyclopropyl-2-fluorobenzenesulfonamide |
| IUPAC Name | 5-bromo-N-cyclopropyl-2-fluorobenzenesulfonamide |
| InChI | InChI=1S/C9H9BrFNO2S/c10-6-1-4-8(11)9(5-6)15(13,14)12-7-2-3-7/h1,4-5,7,12H,2-3H2 |
| InChI Key | XZKNBWPDQWIDQF-UHFFFAOYSA-N |
| MDL Number | MFCD28805684 |
| Molecular Formula | C9H9BrFNO2S |
| Molecular Weight | 294.1407 |
| SMILES | Fc1ccc(cc1S(=O)(=O)NC1CC1)Br |
| Synonyms | 5-bromo-N-cyclopropyl-2-fluorobenzenesulfonamide,
1704121-60-7,
MFCD28805684,
ZINC74946380,
AKOS027423773,
AM87685,
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| Complexity | 326 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 292.952g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 294.138g/mol |
| Monoisotopic Mass | 292.952g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
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