Cas no 58293-40-6 (1,3-Propanediamine, N,N'-dimethyl-N,N'-dioctyl-)

1,3-Propanediamine, N,N'-dimethyl-N,N'-dioctyl- structure
58293-40-6 structure
Product Name:1,3-Propanediamine, N,N'-dimethyl-N,N'-dioctyl-
CAS No:58293-40-6
MF:C21H46N2
MW:326.603346347809
CID:342580
PubChem ID:13398916
Update Time:2025-04-19

1,3-Propanediamine, N,N'-dimethyl-N,N'-dioctyl- Chemical and Physical Properties

Names and Identifiers

    • 1,3-Propanediamine, N,N'-dimethyl-N,N'-dioctyl-
    • N,N'-dimethyl-N,N'-dioctylpropane-1,3-diamine
    • N~1~,N~3~-Dimethyl-N~1~,N~3~-dioctylpropane-1,3-diamine
    • DTXSID40539349
    • SCHEMBL9491977
    • 58293-40-6
    • Inchi: 1S/C21H46N2/c1-5-7-9-11-13-15-18-22(3)20-17-21-23(4)19-16-14-12-10-8-6-2/h5-21H2,1-4H3
    • InChI Key: FLQWOBCKIDGRRB-UHFFFAOYSA-N
    • SMILES: N(C)(CCCCCCCC)CCCN(C)CCCCCCCC

Computed Properties

  • Exact Mass: 326.36638
  • Monoisotopic Mass: 326.366099476g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 18
  • Complexity: 196
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 7.5
  • Topological Polar Surface Area: 6.5?2

Experimental Properties

  • PSA: 6.48
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