Cas no 55405-21-5 ((2,3,5,6-tetrachlorobenzene-1,4-diyl)bis(N,N,N-trimethylmethanaminium) diiodide)

(2,3,5,6-tetrachlorobenzene-1,4-diyl)bis(N,N,N-trimethylmethanaminium) diiodide structure
55405-21-5 structure
Product Name:(2,3,5,6-tetrachlorobenzene-1,4-diyl)bis(N,N,N-trimethylmethanaminium) diiodide
CAS No:55405-21-5
MF:C14H22Cl4I2N2
MW:613.958824634552
CID:1592678
PubChem ID:3043322
Update Time:2025-04-21

(2,3,5,6-tetrachlorobenzene-1,4-diyl)bis(N,N,N-trimethylmethanaminium) diiodide Chemical and Physical Properties

Names and Identifiers

    • (2,3,5,6-tetrachlorobenzene-1,4-diyl)bis(N,N,N-trimethylmethanaminium) diiodide
    • trimethyl-[[2,3,5,6-tetrachloro-4-[(trimethylazaniumyl)methyl]phenyl]methyl]azanium,diiodide
    • 2,3,5,6-Tetrachloro-N,N,N,N',N',N'-hexamethyl-1,4-benzenedimethanaminium diiodide
    • 1,4-Bis(dimethylaminomethyl)-2,3,5,6-tetrachlorobenzene bis(methiodide)
    • N,N'-[(2,3,5,6-Tetrachloro-1,4-phenylene)bis(methylene)]bis(N,N-dimethylmethanaminium) diiodide
    • DTXSID80970752
    • 55405-21-5
    • 1,4-Benzenedimethanaminium, 2,3,5,6-tetrachloro-N,N,N,N',N',N',-hexamethyl-, diiodide
    • Inchi: 1S/C14H22Cl4N2.2HI/c1-19(2,3)7-9-11(15)13(17)10(8-20(4,5)6)14(18)12(9)16;;/h7-8H2,1-6H3;2*1H/q+2;;/p-2
    • InChI Key: QJVPXABUXBASFK-UHFFFAOYSA-L
    • SMILES: [I-].[I-].ClC1C(=C(C(=C(C=1C[N+](C)(C)C)Cl)Cl)C[N+](C)(C)C)Cl

Computed Properties

  • Exact Mass: 589.6898
  • Monoisotopic Mass: 611.862646
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 4
  • Complexity: 276
  • 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: 0

Experimental Properties

  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • PSA: 0
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