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The molecular formula of 5-Bromothiazole-4-carboxylic acid is C4H2BrNO2S.
The molecular weight of 5-Bromothiazole-4-carboxylic acid is 208.04 g/mol.
The IUPAC name of 5-Bromothiazole-4-carboxylic acid is 5-bromo-1,3-thiazole-4-carboxylic acid.
The InChI of 5-Bromothiazole-4-carboxylic acid is InChI=1S/C4H2BrNO2S/c5-3-2(4(7)8)6-1-9-3/h1H,(H,7,8).
The InChIKey of 5-Bromothiazole-4-carboxylic acid is AZYQIQWMHMYDPO-UHFFFAOYSA-N.
The canonical SMILES of 5-Bromothiazole-4-carboxylic acid is C1=NC(=C(S1)Br)C(=O)O.
The CAS number of 5-Bromothiazole-4-carboxylic acid is 103878-58-6.
The XLogP3-AA value of 5-Bromothiazole-4-carboxylic acid is 1.8.
Yes, 5-Bromothiazole-4-carboxylic acid is a canonicalized compound.
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