| CAS Number | 711018-68-7 |
| Catalog Number | AG01B38M |
| Chemical Name | 2-(4-Bromophenyl)ethanesulfonyl Chloride |
| IUPAC Name | 2-(4-bromophenyl)ethanesulfonyl chloride |
| InChI | InChI=1S/C8H8BrClO2S/c9-8-3-1-7(2-4-8)5-6-13(10,11)12/h1-4H,5-6H2 |
| InChI Key | WGUYMLVRJKFPHI-UHFFFAOYSA-N |
| MDL Number | MFCD13190130 |
| Molecular Formula | C8H8BrClO2S |
| Molecular Weight | 283.5699 |
| SMILES | ClS(CCC1=CC=C(Br)C=C1)(=O)=O |
| Synonyms | 711018-68-7,
2-(4-bromo-phenyl)-ethanesulfonyl chloride,
2-(4-BROMOPHENYL)ETHANESULFONYL CHLORIDE,
SCHEMBL2377606,
WGUYMLVRJKFPHI-UHFFFAOYSA-N,
ZINC103595367,
AB69816,
Benzeneethanesulfonyl chloride, 4-bromo-,
2-(4-BROMOPHENYL)ETHANE-1-SULFONYL CHLORIDE,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 281.912g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 283.564g/mol |
| Monoisotopic Mass | 281.912g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
Lot Number