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CS-W001157 4
Total: USD 88.00

3-(4-(tert-Butoxycarbonyl)piperazin-1-yl)benzoic acid

  • CAS No. 193818-13-2

  • Cat. No. CS-0372341
  • Purity≥98%
  • MDL No.None

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

3-(4-(tert-Butoxycarbonyl)piperazin-1-yl)benzoic acid|CS-0372341

Structure of 193818-13-2

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General Information

  • CAS No. 193818-13-2
  • Cat. No. CS-0372341
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₂₂N₂O₄
  • Molecular Weight 306.36
  • Synonym(s) tert-Butyl 4-(3-carboxyphenyl)piperazine-1-carboxylate
  • SMILES O=C(N1CCN(C2=CC=CC(C(O)=O)=C2)CC1)OC(C)(C)C

Synthesis

  • Route1
    • Tert-butyl 4-(3-(ethoxycarbonyl)phenyl)piperazine-1-carboxylate|CS-0318238
      261925-94-4
    • ~82%
    • In-stock
      3-(4-(tert-Butoxycarbonyl)piperazin-1-yl)benzoic acid|CS-0372341
      193818-13-2

    References

    • SIENA BIOTECH S.P.A. Patent: WO2009/74300 A2, 2009 ; Location in patent: Page/Page column 29; 13 ; WO 2009/074300 A2
  • Route2
    • Tert-butyl 4-[3-(methoxycarbonyl)phenyl]piperazine-1-carboxylate|CS-0757081
      179003-10-2
    • ~%
    • In-stock
      3-(4-(tert-Butoxycarbonyl)piperazin-1-yl)benzoic acid|CS-0372341
      193818-13-2

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 19, # 6 p. 1779 - 1783
  • Route3
    • null|null
      179003-08-8
    • ~%
    • In-stock
      3-(4-(tert-Butoxycarbonyl)piperazin-1-yl)benzoic acid|CS-0372341
      193818-13-2

    References

    • Bioorganic and Medicinal Chemistry, , vol. 21, # 15 p. 4646 - 4661

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   70.08
  • LogP   2.4419
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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