958453-77-5 Purity
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Specification
The molecular formula of 4-Fluoro-2-methylsulfanylmethoxy-benzeneboronic acid is C8H10BFO3S.
The molecular weight of 4-Fluoro-2-methylsulfanylmethoxy-benzeneboronic acid is 216.04 g/mol.
4-Fluoro-2-methylsulfanylmethoxy-benzeneboronic acid was created on April 27, 2010.
4-Fluoro-2-methylsulfanylmethoxy-benzeneboronic acid was last modified on December 30, 2023.
The IUPAC name of 4-Fluoro-2-methylsulfanylmethoxy-benzeneboronic acid is [4-fluoro-2-(methylsulfanylmethoxy)phenyl]boronic acid.
The InChI of 4-Fluoro-2-methylsulfanylmethoxy-benzeneboronic acid is InChI=1S/C8H10BFO3S/c1-14-5-13-8-4-6(10)2-3-7(8)9(11)12/h2-4,11-12H,5H2,1H3.
The InChIKey of 4-Fluoro-2-methylsulfanylmethoxy-benzeneboronic acid is LWXMOAGDCGSVGP-UHFFFAOYSA-N.
The canonical SMILES of 4-Fluoro-2-methylsulfanylmethoxy-benzeneboronic acid is B(C1=C(C=C(C=C1)F)OCSC)(O)O.
The CAS number of 4-Fluoro-2-methylsulfanylmethoxy-benzeneboronic acid is 958454-08-5.
Yes, 4-Fluoro-2-methylsulfanylmethoxy-benzeneboronic acid is canonicalized.