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CS-W001157 4
Total: USD 88.00

1-(2-Carboxyphenyl)piperazine

  • CAS No. 446831-27-2

  • Cat. No. CS-0207253
  • Purity98+%
  • MDL No.MFCD03095640

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

1-(2-Carboxyphenyl)piperazine|CS-0207253

Structure of 446831-27-2

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General Information

  • CAS No. 446831-27-2
  • Cat. No. CS-0207253
  • Purity 98+%
  • MDL No. MFCD03095640
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄N₂O₂
  • Molecular Weight 206.24
  • Synonym(s) 2-(Piperazin-1-yl)benzoic acid
  • SMILES C1=CC=C(C(=C1)C(=O)O)N2CCNCC2

Synthesis

  • Route1

    References

    • Richardson, Timothy I.; Ornstein, Paul L.; Briner, Karin; Fisher, Matthew J.; Backer, Ryan T.; Biggers, C. Kelly; Clay, Michael P.; Emmerson, Paul J.; Hertel, Larry W.; Hsiung, Hansen M.; Husain, Saba; Kahl, Steven D.; Lee, Jonathan A.; Lindstrom, Terry D.; Martinelli, Michael J.; Mayer, John P.; Mullaney, Jeffery T.; O'Brien, Thomas P.; Pawlak, Joseph M.; Revell, Kevin D.; Shah, Jikesh; Zgombick, John M.; Herr, R. Jason; Melekhov, Alex; Sampson, Peter B.; King, Chi-Hsin R. Journal of Medicinal Chemistry, 2004 , vol. 47, # 3 p. 744 - 755
  • Route2
    • Methyl 2-(piperazin-1-yl)benzoate|CS-W022794
      159974-63-7
    • ~%
    • 1-(2-Carboxyphenyl)piperazine|CS-0207253
      446831-27-2

    References

    • BAYER HEALTHCARE AG Patent: WO2004/48321 A1, 2004 ; Location in patent: Page/Page column 55 ;

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

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Computational Chemistry Data

  • TPSA   52.57
  • LogP   0.7944
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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