CAS
13466-38-1 Purity
98%
13466-38-1 Purity
98%
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Specification
The molecular formula is C6H4BrF3N2.
The molecular weight is 241.01 g/mol.
It was created on December 5, 2007.
The IUPAC name is 5-bromo-3-(trifluoromethyl)pyridin-2-amine.
The InChI is InChI=1S/C6H4BrF3N2/c7-3-1-4(6(8,9)10)5(11)12-2-3/h1-2H,(H2,11,12).
The Canonical SMILES is C1=C(C=NC(=C1C(F)(F)F)N)Br.
The CAS number is 79456-34-1.
It has 5 hydrogen bond acceptor counts.
The topological polar surface area is 38.9 Ų.
Yes, it is a canonicalized compound.