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CS-W001157 4
Total: USD 88.00

2-(1,4-Dibenzylpiperazin-2-yl)acetonitrile

  • CAS No. 70403-11-1

  • Cat. No. CS-0113994
  • Purity≥98%
  • MDL No.None

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

2-(1,4-Dibenzylpiperazin-2-yl)acetonitrile|CS-0113994

Structure of 70403-11-1

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General Information

  • CAS No. 70403-11-1
  • Cat. No. CS-0113994
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₀H₂₃N₃
  • Molecular Weight 305.42
  • Synonym(s) 2-Cyanomethyl-1,4-dibenzyl-piperazin
  • SMILES N#CCC1N(CC2=CC=CC=C2)CCN(CC3=CC=CC=C3)C1

Synthesis

  • Route1
    • null|null
      151-50-8
    • 1,4-Dibenzyl-2-(chloromethyl)piperazine|CS-0309979
      24225-89-6
    • ~80%
    • In-stock
      2-(1,4-Dibenzylpiperazin-2-yl)acetonitrile|CS-0113994
      70403-11-1

    References

    • Le Bihan, Gaelle; Rondu, Frederic; Pele-Tounian, Agnes; Wang, Xuan; Lidy, Sandrine; Touboul, Estera; Lamouri, Aazdine; Dive, Georges; Huet, Jack; Pfeiffer, Bruno; Renard, Pierre; Guardiola-Lemaitre, Beatrice; Manechez, Dominique; Penicaud, Luc; Ktorza, Alain; Godfroid, Jean-Jacques Journal of Medicinal Chemistry, 1999 , vol. 42, # 9 p. 1587 - 1603
  • Route2
    • (1,4-Dibenzylpiperazin-2-yl)methanol|CS-0113993
      94437-04-4
    • ~%
    • In-stock
      2-(1,4-Dibenzylpiperazin-2-yl)acetonitrile|CS-0113994
      70403-11-1

    References

    • Le Bihan, Gaelle; Rondu, Frederic; Pele-Tounian, Agnes; Wang, Xuan; Lidy, Sandrine; Touboul, Estera; Lamouri, Aazdine; Dive, Georges; Huet, Jack; Pfeiffer, Bruno; Renard, Pierre; Guardiola-Lemaitre, Beatrice; Manechez, Dominique; Penicaud, Luc; Ktorza, Alain; Godfroid, Jean-Jacques Journal of Medicinal Chemistry, 1999 , vol. 42, # 9 p. 1587 - 1603
  • Route3
    • Ethyl 1,4-dibenzylpiperazine-2-carboxylate|CS-0008730
      72351-59-8
    • ~%
    • In-stock
      2-(1,4-Dibenzylpiperazin-2-yl)acetonitrile|CS-0113994
      70403-11-1

    References

    • Le Bihan, Gaelle; Rondu, Frederic; Pele-Tounian, Agnes; Wang, Xuan; Lidy, Sandrine; Touboul, Estera; Lamouri, Aazdine; Dive, Georges; Huet, Jack; Pfeiffer, Bruno; Renard, Pierre; Guardiola-Lemaitre, Beatrice; Manechez, Dominique; Penicaud, Luc; Ktorza, Alain; Godfroid, Jean-Jacques Journal of Medicinal Chemistry, 1999 , vol. 42, # 9 p. 1587 - 1603

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   30.27
  • LogP   3.28668
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   5

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