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CS-W001157 4
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2-Phenyl-2-(piperazin-1-yl)acetonitrile

  • CAS No. 460720-86-9

  • Cat. No. CS-0241575
  • Molecule weight201.27
  • Purity≥95%
  • MDL No.None

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

2-Phenyl-2-(piperazin-1-yl)acetonitrile|CS-0241575

Structure of 460720-86-9

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General Information

  • CAS No. 460720-86-9
  • Cat. No. CS-0241575
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₅N₃
  • Molecular Weight 201.27
  • Synonym(s) Phenyl(piperazin-1-yl)acetonitrile
  • SMILES C1=CC=C(C=C1)C(C#N)N2CCNCC2

Synthesis

  • Route1
    • null|null
      110-85-0
    • null|null
      143-33-9
    • null|null
      100-52-7
    • ~54%
    • null|null
      17761-90-9
    • 2-Phenyl-2-(piperazin-1-yl)acetonitrile|CS-0241575
      460720-86-9

    References

    • Petride, Horia; Corbu, Andreea; Florea, Cristina; Petride, Aurica; Udrea, Silvia Revue Roumaine de Chimie, 2006 , vol. 51, # 7-8 p. 635 - 642
  • Route2
    • null|null
      110-85-0
    • null|null
      151-50-8
    • null|null
      100-52-7
    • ~%
    • 2-Phenyl-2-(piperazin-1-yl)acetonitrile|CS-0241575
      460720-86-9

    References

    • Webster, Scott P.; Ward, Peter; Binnie, Margaret; Craigie, Eilidh; McConnell, Kirsty M.M.; Sooy, Karen; Vinter, Andy; Seckl, Jonathan R.; Walker, Brian R. Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 10 p. 2838 - 2843

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   39.06
  • LogP   1.15648
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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