850568-54-6 Purity
98%
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The molecular formula is C6H4BClFNO4.
The molecular weight is 219.36 g/mol.
It was created on March 14, 2010.
It was last modified on December 2, 2023.
The IUPAC name is (3-chloro-4-fluoro-5-nitrophenyl)boronic acid.
The InChI is InChI=1S/C6H4BClFNO4/c8-4-1-3(7(11)12)2-5(6(4)9)10(13)14/h1-2,11-12H.
The InChIKey is FSLZXVIDAWGPGT-UHFFFAOYSA-N.
The canonical SMILES is B(C1=CC(=C(C(=C1)Cl)F)[N+](=O)[O-])(O)O.
The CAS number is 850568-73-9.