CAS
22245-83-6 Purity
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22245-83-6 Purity
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Specification
The molecular formula is C6H3ClF3N.
The molecular weight is 181.54 g/mol.
The IUPAC name is 2-chloro-3-(trifluoromethyl)pyridine.
The InChI is InChI=1S/C6H3ClF3N/c7-5-4(6(8,9)10)2-1-3-11-5/h1-3H.
The InChIKey is RXATZPCCMYMPME-UHFFFAOYSA-N.
There are 4 hydrogen bond acceptor counts.
The topological polar surface area is 12.9 Ų.
There are 0 defined atom stereocenter counts.
Yes, it is considered a canonicalized compound.
The complexity value is 136.