CAS
97997-76-7 Purity
>98.0%(T)
97997-76-7 Purity
>98.0%(T)
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The molecular formula is C16H17BrN2.
It was created on February 16, 2015.
The IUPAC name is 3-(1-ethylpyridin-1-ium-2-yl)-1-methylindole; bromide.
The InChIKey is DXTIBMYTXYKOKT-UHFFFAOYSA-M.
It has zero hydrogen bond donor counts.
The topological polar surface area is 8.8 Ų.
There are 19 heavy atoms.
Yes, the compound is canonicalized.
It has zero defined atom stereocenter counts.
The molecular weight is 317.22 g/mol.