CAS
503439-50-7 Purity
≥98%
503439-50-7 Purity
≥98%
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Specification
The molecular formula is C8H16N2O.
The molecular weight is 156.23 g/mol.
The IUPAC name is 1-butyl-3-methylimidazol-3-ium;hydroxide.
The Canonical SMILES representation is CCCCN1C=C[N+](=C1)C.[OH-].
There is 1 hydrogen bond donor count.
The exact mass is 156.126263138 g/mol.
There are 3 rotatable bond counts.
The topological polar surface area is 9.8 Å^2.
There are 11 heavy atoms.
Yes, the compound is canonicalized.