454-65-9 Purity
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Specification
The molecular formula of 4-Bromo-benzenesulfonyl fluoride is C6H4BrFO2S.
The molecular weight of 4-Bromo-benzenesulfonyl fluoride is 239.06 g/mol.
The IUPAC name of 4-Bromo-benzenesulfonyl fluoride is 4-bromobenzenesulfonyl fluoride.
The InChI of 4-Bromo-benzenesulfonyl fluoride is InChI=1S/C6H4BrFO2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H.
The InChIKey of 4-Bromo-benzenesulfonyl fluoride is AOXWZFUBFROIHA-UHFFFAOYSA-N.
The Canonical SMILES of 4-Bromo-benzenesulfonyl fluoride is C1=CC(=CC=C1S(=O)(=O)F)Br.
The CAS number of 4-Bromo-benzenesulfonyl fluoride is 498-83-9.
4-Bromo-benzenesulfonyl fluoride has 0 hydrogen bond donor counts.
The topological polar surface area of 4-Bromo-benzenesulfonyl fluoride is 42.5 Å2.
Yes, 4-Bromo-benzenesulfonyl fluoride is a canonicalized compound according to PubChem.