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| IUPAC Name: | 4-hydroxy-2-methylbenzenesulfonic acid |
| Description: | 4-Hydroxy-2-methylbenzenesulfonic Acid is derived from m-Cresol (C781915), which is one of the components that make up liquid rice hull smoke, and may contribute to its anti-inflammatory effects in mice. |
| Molecular Weight: | 188.20 + x(18.02) |
| Molecular Formula: | C7H8O4S·xH2O |
| Canonical SMILES: | CC1=C(C=CC(=C1)O)S(=O)(=O)O |
| InChI: | InChI=1S/C7H8O4S/c1-5-4-6(8)2-3-7(5)12(9,10)11/h2-4,8H,1H3,(H,9,10,11) |
| InChI Key: | PYPXOMYXFFYJIF-UHFFFAOYSA-N |
| Solubility: | DMSO (Slightly), Methanol (Slightly) |
| Appearance: | Dark Brown Solid |
| Storage: | Hygroscopic, -20°C Freezer, Under inert atmosphere |
| References: | Kim, S., et al. J. Agr. Food Chem., 59, 4570 (2011). |
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