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The molecular formula is C10H14O4S.
The synonyms are 5-Hydroxy-p-cymene-2-sulphonic acid, Thymolsulfonic acid, 6-Thymolsulfonic acid.
The molecular weight is 230.28 g/mol.
The IUPAC name is 4-hydroxy-2-methyl-5-propan-2-ylbenzenesulfonic acid.
The InChI is InChI=1S/C10H14O4S/c1-6(2)8-5-10(15(12,13)14)7(3)4-9(8)11/h4-6,11H,1-3H3,(H,12,13,14).
The InChIKey is LYWNNXMNOSKLHY-UHFFFAOYSA-N.
The canonical SMILES is CC1=CC(=C(C=C1S(=O)(=O)O)C(C)C)O.
The CAS number is 96-68-4.
The European Community (EC) number is 202-524-7.
Yes, it is a canonicalized compound.
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