54684-83-2 Purity
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Specification
The molecular formula is C6H2Cl3NO2.
It was created on September 13, 2005, and last modified on December 30, 2023.
The IUPAC name is 2,5,6-trichloropyridine-3-carboxylic acid.
The Canonical SMILES is C1=C(C(=NC(=C1Cl)Cl)Cl)C(=O)O.
The molecular weight is 226.4 g/mol.
The InChI is InChI=1S/C6H2Cl3NO2/c7-3-1-2(6(11)12)4(8)10-5(3)9/h1H,(H,11,12).
The EC Number is 823-455-4.
It has 3 hydrogen bond acceptors.
The topological polar surface area is 50.2 Å2.
Yes, the compound is canonicalized by PubChem.