| CAS Number | 2095409-94-0 |
| Catalog Number | AG01E7T7 |
| Chemical Name | 4-[(2-bromoethyl)sulfanyl]pyridine hydrobromide |
| IUPAC Name | 4-(2-bromoethylsulfanyl)pyridine;hydrobromide |
| InChI | InChI=1S/C7H8BrNS.BrH/c8-3-6-10-7-1-4-9-5-2-7;/h1-2,4-5H,3,6H2;1H |
| InChI Key | XKAFJHXHMSHGCY-UHFFFAOYSA-N |
| MDL Number | MFCD30730481 |
| Molecular Formula | C7H9Br2NS |
| Molecular Weight | 299.0261 |
| SMILES | Br.BrCCSC1=CC=NC=C1 |
| Synonyms | 4-[(2-Bromoethyl)sulfanyl]pyridine hydrobromide,
2095409-94-0,
|
| Complexity | 83.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 298.88g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 299.024g/mol |
| Monoisotopic Mass | 296.882g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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