5-Tert-butyl-2,3-dimethylbenzenesulfonic acid
5-tert-butyl-2,3-dimethylbenzenesulfonic acid
Also Known As: 5-tert-butyl-2,3-dimethylbenzenesulfonic acid|AQ-390/43238236|5-tert-Butyl-2,3-dimethyl-benzenesulfonic acid|5-tert-butyl-2,3-dimethylbenzene-1-sulfonic acid
CAS: 742007-73-4
| Molecular Formula | C12H18O3S |
|---|---|
| Molecular Weight | 242.09767 g/mol |
| LogP | 2.84764 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 242.09767 |
| Monoisotopic Mass | 242.09767 |
| Heavy Atoms | 16 |
| Complexity | 507.80078 |
Chemical Identifiers
| CAS Number | 742007-73-4 |
|---|---|
| SMILES | CC1=CC(=CC(=C1C)S(=O)(=O)O)C(C)(C)C |
Product Overview
5-Tert-butyl-2,3-dimethylbenzenesulfonic acid (CAS 742007-73-4), with molecular formula C12H18O3S and molecular weight 242.09767 g/mol. IUPAC: 5-tert-butyl-2,3-dimethylbenzenesulfonic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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