CAS
762287-58-1 Purity
96%
762287-58-1 Purity
96%
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The molecular formula is C6H5BBrNO4.
The molecular weight is 245.83 g/mol.
It was created on August 8, 2012.
It was last modified on December 2, 2023.
The IUPAC name is 5-borono-2-bromopyridine-3-carboxylic acid.
The InChI is InChI=1S/C6H5BBrNO4/c8-5-4(6(10)11)1-3(2-9-5)7(12)13/h1-2,12-13H,(H,10,11).
The InChIKey is KFCCLRYBPPHKBI-UHFFFAOYSA-N.
The canonical SMILES is B(C1=CC(=C(N=C1)Br)C(=O)O)(O)O.
The CAS number is 1451393-49-9.
It has 3 hydrogen bond donor counts.