66416-72-6 Purity
98%
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Specification
The molecular formula is C6H4BrKO3S.
The synonyms are Potassium 4-bromobenzenesulfonate and 4-Bromo-benzenesulfonic acid potassium salt.
The molecular weight is 275.16 g/mol.
The IUPAC name is potassium;4-bromobenzenesulfonate.
The InChI is InChI=1S/C6H5BrO3S.K/c7-5-1-3-6(4-2-5)11(8,9)10;/h1-4H,(H,8,9,10);/q;+1/p-1.
The InChIKey is ZRRZLMBETUWGJQ-UHFFFAOYSA-M.
The canonical SMILES is C1=CC(=CC=C1S(=O)(=O)[O-])Br.[K+].
The CAS number is 66788-58-7.
The hydrogen bond donor count is 0.
The hydrogen bond acceptor count is 3.