170861-63-9 Purity
98%
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Specification
The molecular formula of 1-Methyl-3-tetradecylimidazolium chloride is C18H35ClN2.
The molecular weight of 1-Methyl-3-tetradecylimidazolium chloride is 314.9 g/mol.
The synonyms of 1-Methyl-3-tetradecylimidazolium chloride are 171058-21-2, 1-Tetradecyl-3-methylimidazolium chloride, 1-Methyl-3-tetradecyl-1H-imidazol-3-ium chloride, and 1-methyl-3-tetradecylimidazol-1-ium; chloride.
The IUPAC name of 1-Methyl-3-tetradecylimidazolium chloride is 1-methyl-3-tetradecylimidazol-1-ium; chloride.
The InChI of 1-Methyl-3-tetradecylimidazolium chloride is InChI=1S/C18H35N2.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-17-16-19(2)18-20;/h16-18H,3-15H2,1-2H3;1H/q+1;/p-1.
The canonical SMILES of 1-Methyl-3-tetradecylimidazolium chloride is CCCCCCCCCCCCCCN1C=C[N+](=C1)C.[Cl-].
The CAS number of 1-Methyl-3-tetradecylimidazolium chloride is 171058-21-2.
The computed properties of 1-Methyl-3-tetradecylimidazolium chloride include its molecular weight (314.9 g/mol), hydrogen bond donor count (0), hydrogen bond acceptor count (1), rotatable bond count (13), exact mass (314.2488768 g/mol), topological polar surface area (8.8Ų), heavy atom count (21), formal charge, complexity (206), isotope atom count, defined atom stereocenter count, undefined atom stereocenter count, defined bond stereocenter count, undefined bond stereocenter count, covalently-bonded unit count (2), and if the compound is canonicalized.
The Parent Compound of 1-Methyl-3-tetradecylimidazolium chloride is 1-Tetradecyl-3-methylimidazolium.
1-Methyl-3-tetradecylimidazolium chloride was created on July 19, 2005, and last modified on October 21, 2023.