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CS-W001157 4
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N,N'-(propane-1,3-diyl)bis(2-cyanoacetamide)

  • CAS No. 111233-69-3

  • Cat. No. CS-0329621
  • Molecule weight208.22
  • Purity≥97%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

N,N'-(propane-1,3-diyl)bis(2-cyanoacetamide)|CS-0329621

Structure of 111233-69-3

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General Information

  • CAS No. 111233-69-3
  • Cat. No. CS-0329621
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂N₄O₂
  • Molecular Weight 208.22
  • Synonym(s) Acetamide, N,N'-1,3-propanediylbis[2-cyano-
  • SMILES N#CCC(NCCCNC(CC#N)=O)=O

Synthesis

  • Route1
    • null|null
      109-76-2
    • null|null
      105-56-6
    • ~98%
    • N,N'-(propane-1,3-diyl)bis(2-cyanoacetamide)|CS-0329621
      111233-69-3

    References

    • Kolotilov, Sergey V.; Schollmeyer, Dieter; Thompson, Laurence K.; Golub, Vladimir; Addison, Anthony W.; Pavlishchuk, Vitaly V. Dalton Transactions, 2008 , # 22 p. 3007 - 3014
  • Route2

    References

    • THE UNIVERSITY OF NEWCASTLE RESEARCH ASSOCIATES LIMITED Patent: WO2005/49009 A1, 2005 ; Location in patent: Page/Page column 31-32 ; WO 2005/049009 A1

Safety Information

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GHS Pictogram : N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   105.78
  • LogP   -0.56374
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   6

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