Cas no 6810-42-0 (Cyclohexanaminium,N-hexadecyl-2-hydroxy-N,N-dimethyl-)

Cyclohexanaminium,N-hexadecyl-2-hydroxy-N,N-dimethyl- structure
6810-42-0 structure
Product Name:Cyclohexanaminium,N-hexadecyl-2-hydroxy-N,N-dimethyl-
CAS No:6810-42-0
MF:C24H50NO
MW:368.659907817841
CID:509441
PubChem ID:110926
Update Time:2025-04-19

Cyclohexanaminium,N-hexadecyl-2-hydroxy-N,N-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • Cyclohexanaminium,N-hexadecyl-2-hydroxy-N,N-dimethyl-
    • hexadecyl-(2-hydroxycyclohexyl)-dimethylazanium
    • N-hexadecyl-2-hydroxy-N,N-dimethylcyclohexanaminium
    • Cethexonium
    • UNII-1V984I1L1M
    • Cethexonium ion
    • N-Hexadecyl-2-hydroxy-N,N-dimethylcyclohexan-1-aminium
    • CHEBI:135555
    • 6810-42-0
    • DTXSID40866703
    • EINECS 229-885-3
    • CETHEXONIUM [WHO-DD]
    • SCHEMBL9811832
    • 1V984I1L1M
    • Q27252953
    • Cyclohexanaminium, N-hexadecyl-2-hydroxy-N,N-dimethyl-
    • Cethexonium cation
    • NS00044375
    • CHEMBL2110776
    • Inchi: 1S/C24H50NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-25(2,3)23-20-17-18-21-24(23)26/h23-24,26H,4-22H2,1-3H3/q+1
    • InChI Key: YPQVDFLBDPTGLB-UHFFFAOYSA-N
    • SMILES: OC1CCCCC1[N+](C)(C)CCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 368.3895
  • Monoisotopic Mass: 368.389240218g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 16
  • Complexity: 315
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 8.7
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • PSA: 20.23
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