n-Octyl p-Toluenesulfonate
octyl 4-methylbenzenesulfonate
Also Known As: Octyl 4-methylbenzenesulfonate|n-Octyl p-Toluenesulfonate|p-Toluenesulfonic Acid n-Octyl Ester|octyl p-toluenesulfonate|n-Octyl-p-toluolsulfonat|octyl 4-methylbenzene-1-sulfonate|n-Octyl-p-Toluenesulfonate|ACMC-209i3h|p-Toluenesulfonic acid octyl|Octyl4-methylbenzenesulfonate|Octyl 4-methylbenzenesulfonate #|4-Methylbenzenesulfonic acid octyl|p-Toluenesulfonic acid octyl ester|Benzenesulfonic acid,4-methyl-, octyl ester|Benzenesulfonic acid, 4-methyl-, octyl ester|4-METHYLBENZENESULFONIC ACID OCTYL ESTER
| Molecular Formula | C15H24O3S |
|---|---|
| Molecular Weight | 284.14462 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 284.14462 |
| Monoisotopic Mass | 284.14462 |
| Heavy Atoms | 19 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 3386-35-4 |
|---|---|
| SMILES | CCCCCCCCOS(=O)(=O)C1=CC=C(C=C1)C |
| InChIKey | LYQJBZLAANNIER-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n-Octyl p-Toluenesulfonate (CAS 3386-35-4), with molecular formula C15H24O3S and molecular weight 284.14462 g/mol. IUPAC: octyl 4-methylbenzenesulfonate.