[2-methyl-5-(trifluoromethylsulfonyl)phenyl]boronic acid

Systemtic Name: [2-methyl-5-(trifluoromethylsulfonyl)phenyl]boronic acid Openeye Name: [2-methyl-5-(trifluoromethylsulfonyl)phenyl]boronic acid CAS Name: [2-methyl-5-(trifluoromethylsulfonyl)phenyl]boronic acid IUPAC Name: [2-methyl-5-(trifluoromethylsulfonyl)phenyl]boronic acid Traditional Name: (2-methyl-5-triflyl-phenyl)boronic acid Formula: C8H8BF3O4S MolecularWeight: 268.01793

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=C(C=CC(=C1)S(=O)(=O)C(F)(F)F)C)(O)O

Isomeric SMILES

B(C1=C(C=CC(=C1)S(=O)(=O)C(F)(F)F)C)(O)O

InChI

InChI=1S/C8H8BF3O4S/c1-5-2-3-6(4-7(5)9(13)14)17(15,16)8(10,11)12/h2-4,13-14H,1H3