(4-Bromophenyl) 4-methylbenzenesulfonate
(4-bromophenyl) 4-methylbenzenesulfonate
Also Known As: 4-bromophenyl tosylate|4-Tosyloxy-1-bromobenzene|(4-bromophenyl) 4-methylbenzenesulfonate|1-Bromo-4-(tosyloxy)benzene|4-BROMOPHENYL 4-METHYLBENZENE-1-SULFONATE|p-bromophenyl p-toluenesulfonate|Phenol, p-bromo-, p-toluene-sulfonate|4-bromophenyl 4-toluenesulfonate|(4-bromophenyl)4-methylbenzenesulfonate|1-bromo-4-(4-methylphenyl)sulfonyloxy-benzene|p-Toluenesulfonic acid 4-bromophenyl ester|4-Bromophenyl 1-(4-methylbenZenesulfonate)|4-BROMOPHENYL 4-METHYLBENZENESULFONATE|J1.311.129D|Phenol, 4-bromo-, 1-(4-methylbenzenesulfonate)
| Molecular Formula | C13H11BrO3S |
|---|---|
| Molecular Weight | 325.96124 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.96124 |
| Monoisotopic Mass | 325.96124 |
| Heavy Atoms | 18 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 822-66-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)Br |
| InChIKey | XXDAIEWTMDQCEL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4-Bromophenyl) 4-methylbenzenesulfonate (CAS 822-66-2), with molecular formula C13H11BrO3S and molecular weight 325.96124 g/mol. IUPAC: (4-bromophenyl) 4-methylbenzenesulfonate.