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CS-W001157 4
Total: USD 88.00

1-(3-Hydroxy-phenyl)-piperazine-4-carboxylic acid tert-butyl ester

  • CAS No. 198627-86-0

  • Cat. No. CS-0213359
  • Purity≥97%
  • MDL No.MFCD04115061

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

1-(3-Hydroxy-phenyl)-piperazine-4-carboxylic acid tert-butyl ester|CS-0213359

Structure of 198627-86-0

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General Information

  • CAS No. 198627-86-0
  • Cat. No. CS-0213359
  • Purity ≥97%
  • MDL No. MFCD04115061
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₂₂N₂O₃
  • Molecular Weight 278.35
  • Synonym(s) Tert-butyl 4-(3-hydroxyphenyl)piperazine-1-carboxylate
  • SMILES CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC=C2)O

Synthesis

  • Route1

    References

    • EXELIXIS, INC. Patent: WO2005/117909 A2, 2005 ; Location in patent: Page/Page column 118 ; WO 2005/117909 A2
  • Route2
    • null|null
      862261-23-2
    • ~99%
    • In-stock
      1-(3-Hydroxy-phenyl)-piperazine-4-carboxylic acid tert-butyl ester|CS-0213359
      198627-86-0

    References

    • Matasi, Julius J.; Caldwell, John P.; Zhang, Hongtao; Fawzi, Ahmad; Higgins, Guy A.; Cohen-Williams, Mary E.; Varty, Geoffrey B.; Tulshian, Deen B. Bioorganic and Medicinal Chemistry Letters, 2005 , vol. 15, # 16 p. 3675 - 3678
  • Route3

    References

    • Karl Thomae Patent: US5994356 A1, 1999 ;

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
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   53.01
  • LogP   2.4493
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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