5471-51-2 Purity
98%
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Specification
The molecular formula is C6H6BrN.
The synonyms are 4-(bromomethyl)pyridine, 54751-01-8, pyridine, 4-(bromomethyl)-, and Pyridine, 4-(bromomethyl)- (9CI).
The molecular weight is 172.02 g/mol.
The IUPAC name is 4-(bromomethyl)pyridine.
The InChI is InChI=1S/C6H6BrN/c7-5-6-1-3-8-4-2-6/h1-4H,5H2.
The InChIKey is KRLKXOLFFQWKPZ-UHFFFAOYSA-N.
The canonical SMILES is C1=CN=CC=C1CBr.
The CAS number is 54751-01-8.
The compound has 0 hydrogen bond donor counts.
The compound has 1 hydrogen bond acceptor count.