CAS
811789-67-0 Purity
≥98%
811789-67-0 Purity
≥98%
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Specification
The molecular formula is C11H19N3S.
The molecular weight is 225.36 g/mol.
It was created on 2007-12-05.
The IUPAC name is 1-hexyl-3-methylimidazol-3-ium;thiocyanate.
The InChIKey is NXPRQOCQANEODQ-UHFFFAOYSA-M.
It has 0 hydrogen bond donor counts.
The exact mass is 225.12996879 g/mol.
It has 5 rotatable bond counts.
The topological polar surface area is 33.6 Ų.
Yes, it is a canonicalized compound.