CAS
94277-32-4 Purity
96%
94277-32-4 Purity
96%
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Specification
The molecular formula is C18H40ClN.
The molecular weight is 306.0 g/mol.
The IUPAC name is 2-ethylhexyl-dimethyl-octylazanium;chloride.
The InChI key is MZJWYVVDXDOBNN-UHFFFAOYSA-M.
The Canonical SMILES is CCCCCCCC[N+](C)(C)CC(CC)CCCC.[Cl-].
The CAS number is 94277-44-8.
It has 0 hydrogen bond donor count.
It has 13 rotatable bond count.
The topological polar surface area is 0.2.
Yes, the compound is canonicalized.