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The molecular formula of 2-(methylthio)-1,3-thiazole-4-carboxylic acid is C5H5NO2S2.
The molecular weight of 2-(methylthio)-1,3-thiazole-4-carboxylic acid is 175.2 g/mol.
The IUPAC name of 2-(methylthio)-1,3-thiazole-4-carboxylic acid is 2-methylsulfanyl-1,3-thiazole-4-carboxylic acid.
The InChI of 2-(methylthio)-1,3-thiazole-4-carboxylic acid is InChI=1S/C5H5NO2S2/c1-9-5-6-3(2-10-5)4(7)8/h2H,1H3,(H,7,8).
The InChIKey of 2-(methylthio)-1,3-thiazole-4-carboxylic acid is KTXGEQDZJYTMBM-UHFFFAOYSA-N.
The Canonical SMILES of 2-(methylthio)-1,3-thiazole-4-carboxylic acid is CSC1=NC(=CS1)C(=O)O.
2-(methylthio)-1,3-thiazole-4-carboxylic acid has 1 hydrogen bond donor count.
The topological polar surface area of 2-(methylthio)-1,3-thiazole-4-carboxylic acid is 104Ų.
2-(methylthio)-1,3-thiazole-4-carboxylic acid has 2 rotatable bond counts.
Yes, the compound is canonicalized for 2-(methylthio)-1,3-thiazole-4-carboxylic acid.
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