CAS
3233-58-7 Purity
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3233-58-7 Purity
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Specification
The molecular formula is C5H3FO2S.
The molecular weight is 146.14 g/mol.
The IUPAC name is 3-fluorothiophene-2-carboxylic acid.
The InChI key is WPHRBUAOSDHRDS-UHFFFAOYSA-N.
The canonical SMILES is C1=CSC(=C1F)C(=O)O.
The CAS number is 32431-84-8.
The European Community (EC) number is 805-834-6.
The ChEMBL ID is CHEMBL4277294.
The XLogP3-AA value is 1.6.
Yes, it is a canonicalized compound.