Cas no 94119-93-4 (1-Hexadecanaminium, N,N,N-trioctyl-, iodide)

1-Hexadecanaminium, N,N,N-trioctyl-, iodide structure
94119-93-4 structure
Product Name:1-Hexadecanaminium, N,N,N-trioctyl-, iodide
CAS No:94119-93-4
MF:C40H84IN
MW:706.006145477295
CID:752395
PubChem ID:14475157
Update Time:2025-04-19

1-Hexadecanaminium, N,N,N-trioctyl-, iodide Chemical and Physical Properties

Names and Identifiers

    • 1-Hexadecanaminium, N,N,N-trioctyl-, iodide
    • hexadecyl(trioctyl)azanium,iodide
    • hexadecyltrioctylammonium iodide
    • N,N,N-Trioctylhexadecan-1-aminium iodide
    • SCHEMBL5092326
    • 94119-93-4
    • DTXSID50560765
    • Inchi: 1S/C40H84N.HI/c1-5-9-13-17-21-22-23-24-25-26-27-28-32-36-40-41(37-33-29-18-14-10-6-2,38-34-30-19-15-11-7-3)39-35-31-20-16-12-8-4;/h5-40H2,1-4H3;1H/q+1;/p-1
    • InChI Key: ARRZFHFQNQKXCX-UHFFFAOYSA-M
    • SMILES: [I-].[N+](CCCCCCCC)(CCCCCCCC)(CCCCCCCC)CCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 705.56485g/mol
  • Monoisotopic Mass: 705.56485g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 42
  • Rotatable Bond Count: 36
  • Complexity: 417
  • Covalently-Bonded Unit Count: 2
  • 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
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