CAS
--- Purity
≥98%
--- Purity
≥98%
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Specification
The molecular formula is C12H17N5.
It was created on September 13, 2017.
The computed IUPAC name is 1-butyl-3-prop-2-enylimidazol-1-ium;cyanoiminomethylideneazanide.
The InChIKey is HMKWFNXSVWPZBR-UHFFFAOYSA-N.
It has 3 hydrogen bond acceptors.
The molecular weight is 231.30 g/mol.
The exact mass is 231.14839556 g/mol.
It has 5 rotatable bonds.
The topological polar surface area is 46 Ų.
Yes, it is considered canonicalized.