Cas no 61363-36-8 (1-Pentanaminium, N,N,N-trimethyl-4-oxo-, chloride)

1-Pentanaminium, N,N,N-trimethyl-4-oxo-, chloride structure
61363-36-8 structure
Product Name:1-Pentanaminium, N,N,N-trimethyl-4-oxo-, chloride
CAS No:61363-36-8
MF:C8H18ClNO
MW:179.687621593475
CID:482300
PubChem ID:13332681
Update Time:2025-04-19

1-Pentanaminium, N,N,N-trimethyl-4-oxo-, chloride Chemical and Physical Properties

Names and Identifiers

    • 1-Pentanaminium, N,N,N-trimethyl-4-oxo-, chloride
    • trimethyl(4-oxopentyl)azanium,chloride
    • 4-ketoamyltrimethyl-ammonium chloride
    • DTXSID60537180
    • 61363-36-8
    • N,N,N-Trimethyl-4-oxopentan-1-aminium chloride
    • Inchi: 1S/C8H18NO.ClH/c1-8(10)6-5-7-9(2,3)4;/h5-7H2,1-4H3;1H/q+1;/p-1
    • InChI Key: AIJVDAUHIXPBIJ-UHFFFAOYSA-M
    • SMILES: [Cl-].O=C(C)CCC[N+](C)(C)C

Computed Properties

  • Exact Mass: 160.9669
  • Monoisotopic Mass: 179.1076919g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 4
  • Complexity: 113
  • 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: 17.1?2

Experimental Properties

  • PSA: 17.07
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