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CS-W001157 4
Total: USD 88.00

2-(4-Benzylpiperazin-1-yl)acetonitrile

  • CAS No. 92042-93-8

  • Cat. No. CS-0212923
  • Purity≥98%
  • MDL No.MFCD00078192

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

2-(4-Benzylpiperazin-1-yl)acetonitrile|CS-0212923

Structure of 92042-93-8

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General Information

  • CAS No. 92042-93-8
  • Cat. No. CS-0212923
  • Purity ≥98%
  • MDL No. MFCD00078192
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₇N₃
  • Molecular Weight 215.29
  • Synonym(s) 4-Benzylpiperazine-1-acetonitrile
  • SMILES C1=CC=C(C=C1)CN2CCN(CC#N)CC2

Synthesis

  • Route1
    • null|null
      2759-28-6
    • null|null
      107-14-2
    • ~96%
    • 2-(4-Benzylpiperazin-1-yl)acetonitrile|CS-0212923
      92042-93-8

    References

    • Contreras; Parrot; Sippl; Rival; Wermuth Journal of Medicinal Chemistry, 2001 , vol. 44, # 17 p. 2707 - 2718
  • Route2
    • null|null
      2759-28-6
    • null|null
      590-17-0
    • ~83%
    • 2-(4-Benzylpiperazin-1-yl)acetonitrile|CS-0212923
      92042-93-8

    References

    • Ahmad, Youssef El; Laurent, Elisabeth; Maillet, Philippe; Talab, Akram; Teste, Jean Francois; Dokhan, Raymond; Tran, Gilles; Ollivier, Roland Journal of Medicinal Chemistry, 1997 , vol. 40, # 6 p. 952 - 960
  • Route3
    • null|null
      83991-49-5
    • null|null
      143-33-9
    • ~86%
    • 2-(4-Benzylpiperazin-1-yl)acetonitrile|CS-0212923
      92042-93-8

    References

    • Chaudhary, Preeti; Nimesh, Surendra; Yadav, Veena; Verma, Akhilesh Kr.; Kumar, Rupesh European Journal of Medicinal Chemistry, 2007 , vol. 42, # 4 p. 471 - 476

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

  • TPSA   30.27
  • LogP   1.32778
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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