Cas no 13118-08-6 (Pyrrolidinium,1,1'-hexamethylenebis[1-methyl-, diiodide (8CI))

Pyrrolidinium,1,1'-hexamethylenebis[1-methyl-, diiodide (8CI) structure
13118-08-6 structure
Product Name:Pyrrolidinium,1,1'-hexamethylenebis[1-methyl-, diiodide (8CI)
CAS No:13118-08-6
MF:C16H34I2N2
MW:508.263509273529
CID:166392
PubChem ID:202703
Update Time:2025-04-19

Pyrrolidinium,1,1'-hexamethylenebis[1-methyl-, diiodide (8CI) Chemical and Physical Properties

Names and Identifiers

    • 1-methyl-1-[6-(1-methylpyrrolidin-1-ium-1-yl)hexyl]pyrrolidin-1-ium,diiodide
    • DTXSID60927108
    • 13118-08-6
    • Pyrrolidinium, 1,1'-hexamethylenebis(1-methyl-, diiodide
    • 1,1'-(Hexane-1,6-diyl)bis(1-methylpyrrolidin-1-ium) diiodide
    • 1,1'-Hexamethylenebis(1-methylpyrrolidinium iodide)
    • Pyrrolidinium,1,1'-hexamethylenebis[1-methyl-, diiodide (8CI)
    • Inchi: 1S/C16H34N2.2HI/c1-17(13-7-8-14-17)11-5-3-4-6-12-18(2)15-9-10-16-18;;/h3-16H2,1-2H3;2*1H/q+2;;/p-2
    • InChI Key: JXSGAHRYLFSMPM-UHFFFAOYSA-L
    • SMILES: [I-].[I-].[N+]1(C)(CCCCCC[N+]2(C)CCCC2)CCCC1

Computed Properties

  • Exact Mass: 473.8142
  • Monoisotopic Mass: 508.08114g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 7
  • Complexity: 212
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0
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