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CS-W001157 4
Total: USD 88.00

1-(4-Nitrobenzyl)piperidine

  • CAS No. 59507-44-7

  • Cat. No. CS-0210341
  • Purity≥98%
  • MDL No.MFCD01453278

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

1-(4-Nitrobenzyl)piperidine|CS-0210341

Structure of 59507-44-7

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General Information

  • CAS No. 59507-44-7
  • Cat. No. CS-0210341
  • Purity ≥98%
  • MDL No. MFCD01453278
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆N₂O₂
  • Molecular Weight 220.27
  • Synonym(s) 1-[(4-NITROPHENYL)METHYL]-PIPERIDINE
  • SMILES C1CCN(CC1)CC2=CC=C(C=C2)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Lagu, Bharat; Wachter, Michael Patent: US2006/293379 A1, 2006 ; Location in patent: Page/Page column 66-67 ; US 20060293379 A1
  • Route2
    • null|null
      110-89-4
    • null|null
      100-11-8
    • ~10%
    • 1-(4-Nitrobenzyl)piperidine|CS-0210341
      59507-44-7

    References

    • Murugesan, Dinakaran; Mital, Alka; Kaiser, Marcel; Shackleford, David M.; Morizzi, Julia; Katneni, Kasiram; Campbell, Michael; Hudson, Alan; Charman, Susan A.; Yeates, Clive; Gilbert, Ian H. Journal of Medicinal Chemistry, 2013 , vol. 56, # 7 p. 2975 - 2990
  • Route3

    References

    • Chen, Wen-Xin; Zhang, Cai-Yun; Shao, Li-Xiong Tetrahedron, 2014 , vol. 70, # 4 p. 880 - 885

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   46.38
  • LogP   2.5807
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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