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CS-W001157 4
Total: USD 88.00

2-(4-(tert-Butoxycarbonyl)-2-oxopiperazin-1-yl)acetic acid

  • CAS No. 549506-47-0

  • Cat. No. CS-0035671
  • Purity≥97%
  • MDL No.MFCD04115297

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

2-(4-(tert-Butoxycarbonyl)-2-oxopiperazin-1-yl)acetic acid|CS-0035671

Structure of 549506-47-0

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General Information

  • CAS No. 549506-47-0
  • Cat. No. CS-0035671
  • Purity ≥97%
  • MDL No. MFCD04115297
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₈N₂O₅
  • Molecular Weight 258.27
  • Synonym(s) None
  • SMILES O=C(OC(C)(C)C)N1CC(=O)N(CC(=O)O)CC1

Synthesis

  • Route1
    • tert-Butyl 4-(2-ethoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate|CS-1317491
      1198287-13-6
    • ~87%
    • In-stock
      2-(4-(tert-Butoxycarbonyl)-2-oxopiperazin-1-yl)acetic acid|CS-0035671
      549506-47-0

    References

    • ZALICUS PHARMACEUTICALS LTD.; PAJOUHESH, Hassan; GRIMWOOD, Mike; ZHU, Yongbao; DING, Yanbing Patent: WO2011/26241 A1, 2011 ; Location in patent: Page/Page column 32-33 ; WO 2011/026241 A1
  • Route2

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 13, # 4 p. 723 - 728
  • Route3
    • In-stock
      Di-tert-butyl dicarbonate|CS-0017817
      24424-99-5
    • 2-(2-Oxopiperazin-1-yl)acetic acid|CS-0155240
      24860-46-6
    • ~%
    • In-stock
      2-(4-(tert-Butoxycarbonyl)-2-oxopiperazin-1-yl)acetic acid|CS-0035671
      549506-47-0

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 13, # 4 p. 723 - 728

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   87.15
  • LogP   0.1503
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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