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The molecular formula is C6H5BrO3S.
The molecular weight is 237.07 g/mol.
It was created on May 23, 2011.
The IUPAC name is 1-(5-bromothiophen-2-yl)-2,2-dihydroxyethanone.
The InChI is InChI=1S/C6H5BrO3S/c7-4-2-1-3(11-4)5(8)6(9)10/h1-2,6,9-10H.
The InChIKey is HURJBJVXFHMXNU-UHFFFAOYSA-N.
The canonical SMILES is C1=C(SC(=C1)Br)C(=O)C(O)O.
The CAS number is 852619-28-4.
The XLogP3-AA value is 1.4.
Yes, it is a canonicalized compound.
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