174899-72-0 Purity
≥98%
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Specification
The molecular formula of 1-octyl-3-methylimidazolium nitrate is C12H23N3O3.
The molecular weight of 1-octyl-3-methylimidazolium nitrate is 257.33 g/mol.
The IUPAC name of 1-octyl-3-methylimidazolium nitrate is 1-methyl-3-octylimidazol-1-ium nitrate.
The InChI of 1-octyl-3-methylimidazolium nitrate is InChI=1S/C12H23N2.NO3/c1-3-4-5-6-7-8-9-14-11-10-13(2)12-14;2-1(3)4/h10-12H,3-9H2,1-2H3;/q+1;-1.
The InChIKey of 1-octyl-3-methylimidazolium nitrate is NQHPXYPSGSMQMA-UHFFFAOYSA-N.
The canonical SMILES of 1-octyl-3-methylimidazolium nitrate is CCCCCCCCN1C=C[N+](=C1)C.[N+](=O)([O-])[O-].
The CAS number of 1-octyl-3-methylimidazolium nitrate is 203389-27-9.
The hydrogen bond donor count of 1-octyl-3-methylimidazolium nitrate is 0.
The hydrogen bond acceptor count of 1-octyl-3-methylimidazolium nitrate is 3.
Yes, 1-octyl-3-methylimidazolium nitrate is a canonicalized compound.