Cas no 854484-96-1 (N,N-Dimethylethanediamine-d6)

N,N-Dimethylethanediamine-d6 structure
N,N-Dimethylethanediamine-d6 structure
Product Name:N,N-Dimethylethanediamine-d6
CAS No:854484-96-1
MF:C4H12N2
MW:94.1884508132935
CID:1060269
PubChem ID:121487915
Update Time:2025-04-20

N,N-Dimethylethanediamine-d6 Chemical and Physical Properties

Names and Identifiers

    • N,N-Dimethylethanediamine-d6
    • N',N'-bis(trideuteriomethyl)ethane-1,2-diamine
    • N,N-Dimethylethanediamine-d6 Dihydrochloride
    • 854484-96-1
    • N,N-(Dimethyl-d6)ethylenediamine Dihydrochloride; N,N-(Dimethyl-d6)-ethane-1,2-diamine; N,N-(Dimethyl-d6)-1,2-ethylenediamine Dihydrochloride;
    • Inchi: 1S/C4H12N2/c1-6(2)4-3-5/h3-5H2,1-2H3/i1D3,2D3
    • InChI Key: DILRJUIACXKSQE-WFGJKAKNSA-N
    • SMILES: N(C([2H])([2H])[2H])(C([2H])([2H])[2H])CCN

Computed Properties

  • Exact Mass: 88.10000
  • Monoisotopic Mass: 94.137708867g/mol
  • Isotope Atom Count: 6
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 6
  • Rotatable Bond Count: 2
  • Complexity: 26.7
  • 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: -0.7
  • Topological Polar Surface Area: 29.3?2

Experimental Properties

  • PSA: 29.26000
  • LogP: 0.20700
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