754-03-0 Purity
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Specification
The molecular formula of 3,5-Dimethylbenzenesulfonyl fluoride is C8H9FO2S.
The molecular weight of 3,5-Dimethylbenzenesulfonyl fluoride is 188.22 g/mol.
The IUPAC name of 3,5-Dimethylbenzenesulfonyl fluoride is 3,5-dimethylbenzenesulfonyl fluoride.
The InChI of 3,5-Dimethylbenzenesulfonyl fluoride is InChI=1S/C8H9FO2S/c1-6-3-7(2)5-8(4-6)12(9,10)11/h3-5H,1-2H3.
The InChIKey of 3,5-Dimethylbenzenesulfonyl fluoride is USDUCJJANRAWTQ-UHFFFAOYSA-N.
The Canonical SMILES of 3,5-Dimethylbenzenesulfonyl fluoride is CC1=CC(=CC(=C1)S(=O)(=O)F)C.
The CAS number of 3,5-Dimethylbenzenesulfonyl fluoride is 86146-00-1.
The European Community (EC) Number of 3,5-Dimethylbenzenesulfonyl fluoride is 809-775-7.
The XLogP3-AA value of 3,5-Dimethylbenzenesulfonyl fluoride is 2.4.
Yes, 3,5-Dimethylbenzenesulfonyl fluoride is a canonicalized compound.