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| IUPAC Name: | 2,4-dimethylbenzenesulfonic acidhydrate |
| Description: | 2,4-Xylenesulfonic Acid, is used for the preparation of 2,4,5,6-Tetrachloro-m-xylene (T291555). It is also an intermediate for the synthesis of Diphenylbismuth arenesulfonates. |
| Molecular Weight: | 204.24 |
| Molecular Formula: | C8H12O4S |
| Canonical SMILES: | CC1=CC(=C(C=C1)S(=O)(=O)O)C.O |
| InChI: | InChI=1S/C8H10O3S.H2O/c1-6-3-4-8(7(2)5-6)12(9,10)11/h3-5H,1-2H3,(H,9,10,11)1H2 |
| InChI Key: | HDUCBEFDSITHBU-UHFFFAOYSA-N |
| Melting Point: | 60-62°C |
| Solubility: | Methanol (Slightly), Water (Slightly) |
| Appearance: | Off-White Solid |
| Storage: | -20°C Freezer, Under inert atmosphere |
| References: | Sharutin, V. V., et al. Russian J. Gen. Chem., 70, 687 (2000). |
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