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CS-W001157 4
Total: USD 88.00

1-Benzylpiperazin-2-one hydrochloride

  • CAS No. 78551-58-3

  • Cat. No. CS-0455806
  • Molecule weight226.70
  • Purity≥98%
  • MDL No.None

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

1-Benzylpiperazin-2-one hydrochloride|CS-0455806

Structure of 78551-58-3

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General Information

  • CAS No. 78551-58-3
  • Cat. No. CS-0455806
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₅ClN₂O
  • Molecular Weight 226.70
  • Synonym(s) 1-benzyl-2-oxopiperazine hydrochloride
  • SMILES C1=CC=C(C=C1)CN2CCNCC2=O.Cl

Synthesis

  • Route1
    • tert-Butyl 4-benzyl-3-oxopiperazine-1-carboxylate|CS-0163136
      78551-60-7
    • ~99%
    • 1-Benzylpiperazin-2-one hydrochloride|CS-0455806
      78551-58-3

    References

    • Haley, Gregory Jay; Kong, Norman; Liu, Emily Aijun; Simonsen, Klaus B.; Vu, Binh Thanh; Webber, Stephen Evan Patent: US2004/259884 A1, 2004 ; Location in patent: Page 13 ;
  • Route2
    • null|null
      107235-76-7
    • ~59%
    • 1-Benzylpiperazin-2-one hydrochloride|CS-0455806
      78551-58-3

    References

    • Tsizin, Yu.S.; Sergovskaya, N.L.; Chernyak, S.A. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1986 , vol. 22, # 4 p. 421 - 424 Khimiya Geterotsiklicheskikh Soedinenii, 1986 , vol. 22, # 4 p. 514 - 517
  • Route3
    • null|null
      107235-77-8
    • ~%
    • 1-Benzylpiperazin-2-one hydrochloride|CS-0455806
      78551-58-3

    References

    • Chemistry of Heterocyclic Compounds (New York, NY, United States), , vol. 22, # 4 p. 421 - 424 Khimiya Geterotsiklicheskikh Soedinenii, , vol. 22, # 4 p. 514 - 517

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   32.34
  • LogP   1.0402
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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