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CS-W001157 4
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1-Benzylpiperazin-2-one

  • CAS No. 59702-21-5

  • Cat. No. CS-0117045
  • Molecule weight190.24
  • Purity≥98%
  • MDL No.None

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

1-Benzylpiperazin-2-one|CS-0117045

Structure of 59702-21-5

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General Information

  • CAS No. 59702-21-5
  • Cat. No. CS-0117045
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄N₂O
  • Molecular Weight 190.24
  • Synonym(s) 2-Piperazinone, 1-(phenylmethyl)-
  • SMILES O=C1N(CC2=CC=CC=C2)CCNC1

Synthesis

  • Route1
    • tert-Butyl 4-benzyl-3-oxopiperazine-1-carboxylate|CS-0163136
      78551-60-7
    • ~92%
    • 1-Benzylpiperazin-2-one|CS-0117045
      59702-21-5

    References

    • Roche Palo Alto LLC Patent: US2009/209553 A1, 2009 ; Location in patent: Page/Page column 15 ;
  • Route2
    • null|null
      79179-76-3
    • ~81%
    • 1-Benzylpiperazin-2-one|CS-0117045
      59702-21-5

    References

    • Hori; Yoshida; Murakami; Takeno; Kiba; Tsuda; Kishimoto; Saikawa Chemical and Pharmaceutical Bulletin, 1981 , vol. 29, # 6 p. 1594 - 1605
  • Route3
    • null|null
      100-39-0
    • ~%
    • 1-Benzylpiperazin-2-one|CS-0117045
      59702-21-5

    References

    • Synthesis, , # 3 art. no. M05504SS, p. 465 - 469

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   32.34
  • LogP   0.6184
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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