1-Methyl-3-octyl-3-imidazolium Bis[(trifluoromethyl)sulfonyl]methanide - CAS 916729-96-9
Catalog: |
BB040304 |
Product Name: |
1-Methyl-3-octyl-3-imidazolium Bis[(trifluoromethyl)sulfonyl]methanide |
CAS: |
916729-96-9 |
Synonyms: |
1-methyl-3-octylimidazol-1-ium;trifluoro(trifluoromethylsulfonylmethylsulfonyl)methane; 1-methyl-3-octylimidazol-1-ium;trifluoro(trifluoromethylsulfonylmethylsulfonyl)methane |
IUPAC Name: | 1-methyl-3-octylimidazol-1-ium;trifluoro(trifluoromethylsulfonylmethylsulfonyl)methane |
Description: | 1-Methyl-3-octyl-3-imidazolium Bis[(trifluoromethyl)sulfonyl]methanide (CAS# 916729-96-9 ) is a useful research chemical. |
Molecular Weight: | 474.48 |
Molecular Formula: | C15H24F6N2O4S2 |
Canonical SMILES: | CCCCCCCCN1C=C[N+](=C1)C.[CH-](S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F |
InChI: | InChI=1S/C12H23N2.C3HF6O4S2/c1-3-4-5-6-7-8-9-14-11-10-13(2)12-14;4-2(5,6)14(10,11)1-15(12,13)3(7,8)9/h10-12H,3-9H2,1-2H3;1H/q+1;-1 |
InChI Key: | NXPDVDJZADEBDB-UHFFFAOYSA-N |
LogP: | 5.80960 |
PMID | Publication Date | Title | Journal |
21092750 | 20110201 | Ionic liquid-based dispersive liquid-liquid microextraction and enhanced spectrophotometric determination of molybdenum (VI) in water and plant leaves samples by FO-LADS | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association |
Complexity: | 507 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 474.10816857 |
Formal Charge: | 0 |
Heavy Atom Count: | 29 |
Hydrogen Bond Acceptor Count: | 11 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 474.10816857 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 93.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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