Cas no 111960-92-0 (1,6-Hexanediaminium,N1,N1,N6,N6-tetrabutyl-N1,N6-diethyl-, hydroxide (1:2))

1,6-Hexanediaminium,N1,N1,N6,N6-tetrabutyl-N1,N6-diethyl-, hydroxide (1:2) structure
111960-92-0 structure
Product Name:1,6-Hexanediaminium,N1,N1,N6,N6-tetrabutyl-N1,N6-diethyl-, hydroxide (1:2)
CAS No:111960-92-0
MF:C26H60N2O2
MW:432.766808509827
CID:150811
PubChem ID:163875
Update Time:2025-04-19

1,6-Hexanediaminium,N1,N1,N6,N6-tetrabutyl-N1,N6-diethyl-, hydroxide (1:2) Chemical and Physical Properties

Names and Identifiers

    • 1,6-Hexanediaminium,N1,N1,N6,N6-tetrabutyl-N1,N6-diethyl-, hydroxide (1:2)
    • UD39MJ7397
    • 1,6-Hexanediaminium, N,N,N',N'-tetrabutyl-N,N'-diethyl-, dihydroxide
    • Q27894281
    • 111960-92-0
    • 1,6-Hexanediaminium, N1,N1,N6,N6-tetrabutyl-N1,N6-diethyl-, hydroxide (1:2)
    • UNII-UD39MJ7397
    • SCHEMBL8910658
    • 1,6-Bis(dibutylethylammonium)hexane dihydroxide
    • N,N,N',N'-tetrabutyl-N,N'-diethylhexane-1,6-diaminium dihydroxide
    • N,N,N',N'-Tetrabutyl-N,N'-diethyl-1,6-hexanediaminium dihydroxide
    • DTXSID3029574
    • Inchi： 1S/C26H58N2.2H2O/c1-7-13-21-27(11-5,22-14-8-2)25-19-17-18-20-26-28(12-6,23-15-9-3)24-16-10-4;;/h7-26H2,1-6H3;2*1H2/q+2;;/p-2
    • InChI Key： PCEZUHYPKVRJEN-UHFFFAOYSA-L
    • SMILES： [OH-].[OH-].[N+](CC)(CCCC)(CCCC)CCCCCC[N+](CC)(CCCC)CCCC

Computed Properties

  • Exact Mass: 432.4658
  • Monoisotopic Mass: 432.465479
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 21
  • Complexity: 278
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 2

Experimental Properties

  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • PSA: 60

1,6-Hexanediaminium,N1,N1,N6,N6-tetrabutyl-N1,N6-diethyl-, hydroxide (1:2) Related Literature

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