CAS
20780-72-7 Purity
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20780-72-7 Purity
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The molecular formula is C6H4BrNO2.
The synonym is 6-Bromopicolinic acid.
The molecular weight is 202.01 g/mol.
The IUPAC name is 6-bromopyridine-2-carboxylic acid.
The InChI is InChI=1S/C6H4BrNO2/c7-5-3-1-2-4(8-5)6(9)10/h1-3H,(H,9,10).
The InChIKey is XURXQNUIGWHWHU-UHFFFAOYSA-N.
The canonical SMILES is C1=CC(=NC(=C1)Br)C(=O)O.
The CAS number is 21190-87-4.
The XLogP3-AA value is 1.7.
Yes, 6-Bromo-2-pyridinecarboxylic acid is a canonicalized compound.