16858-01-8 Purity
97%
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Specification
The molecular formula is C6H2ClF3O2S.
The molecular weight is 230.59 g/mol.
The IUPAC name is 2,3,4-trifluorobenzenesulfonyl chloride.
The InChI is InChI=1S/C6H2ClF3O2S/c7-13(11,12)4-2-1-3(8)5(9)6(4)10/h1-2H.
The InChIKey is XFTDZYFHXRZLEF-UHFFFAOYSA-N.
The canonical SMILES is C1=CC(=C(C(=C1F)F)F)S(=O)(=O)Cl.
The CAS number is 175278-08-7.
The European Community (EC) number is 624-262-6.
The DTXSID is DTXSID20380316.
Yes, it is a canonicalized compound according to PubChem.
Reference: [1]Patent: US6440966,2002,B1
* For details of the synthesis route, please refer to the original source to ensure accuracy.