| CAS Number | 315495-26-2 |
| Catalog Number | AG01AA20 |
| Chemical Name | (E)-2-(4-bromophenyl)ethene-1-sulfonyl chloride |
| IUPAC Name | 2-(4-bromophenyl)ethenesulfonyl chloride |
| InChI | InChI=1S/C8H6BrClO2S/c9-8-3-1-7(2-4-8)5-6-13(10,11)12/h1-6H |
| InChI Key | QAAQAKSRVIIUEV-UHFFFAOYSA-N |
| MDL Number | MFCD12192926 |
| Molecular Formula | C8H6BrClO2S |
| Molecular Weight | 281.5540 |
| SMILES | ClS(/C=C/C1=CC=C(Br)C=C1)(=O)=O |
| Synonyms | 315495-26-2,
2-(4-bromophenyl)ethene-1-sulfonyl chloride,
|
| Complexity | 273 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.896g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 281.548g/mol |
| Monoisotopic Mass | 279.896g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 3.1 |
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