Cas no 62117-41-3 (1-Octadecanaminium, N,N-dimethyl-N-[(triethoxysilyl)methyl]-, chloride)

1-Octadecanaminium, N,N-dimethyl-N-[(triethoxysilyl)methyl]-, chloride structure
62117-41-3 structure
Product Name:1-Octadecanaminium, N,N-dimethyl-N-[(triethoxysilyl)methyl]-, chloride
CAS No:62117-41-3
MF:C27H60ClNO3Si
MW:510.308709144592
CID:457518
PubChem ID:71389770
Update Time:2025-04-19

1-Octadecanaminium, N,N-dimethyl-N-[(triethoxysilyl)methyl]-, chloride Chemical and Physical Properties

Names and Identifiers

    • 1-Octadecanaminium, N,N-dimethyl-N-[(triethoxysilyl)methyl]-, chloride
    • dimethyl-octadecyl-(triethoxysilylmethyl)azanium,chloride
    • DTXSID40811738
    • 62117-41-3
    • N,N-Dimethyl-N-[(triethoxysilyl)methyl]octadecan-1-aminium chloride
    • Inchi: 1S/C27H60NO3Si.ClH/c1-7-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-28(5,6)27-32(29-8-2,30-9-3)31-10-4;/h7-27H2,1-6H3;1H/q+1;/p-1
    • InChI Key: AVLFOFJZNSWNSZ-UHFFFAOYSA-M
    • SMILES: [Cl-].[Si](C[N+](C)(C)CCCCCCCCCCCCCCCCCC)(OCC)(OCC)OCC

Computed Properties

  • Exact Mass: 448.9336
  • Monoisotopic Mass: 509.4030990g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 33
  • Rotatable Bond Count: 25
  • Complexity: 376
  • 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: 27.7?2

Experimental Properties

  • PSA: 27.69
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