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CS-W001157 4
Total: USD 88.00

2-(4-(4-Nitrophenyl)piperazin-1-yl)ethanol

  • CAS No. 5521-38-0

  • Cat. No. CS-0157617
  • Molecule weight251.28
  • Purity≥95%
  • MDL No.None

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

2-(4-(4-Nitrophenyl)piperazin-1-yl)ethanol|CS-0157617

Structure of 5521-38-0

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General Information

  • CAS No. 5521-38-0
  • Cat. No. CS-0157617
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₇N₃O₃
  • Molecular Weight 251.28
  • Synonym(s) 2-[4-(4-NITROPHENYL)PIPERAZINO]-1-ETHANOL
  • SMILES C1=C(C=CC(=C1)[N+](=O)[O-])N2CCN(CC2)CCO

Synthesis

  • Route1

    References

    • AURIGENE DISCOVERY TECHNOLOGIES LIMITED; SENGUPTA, Saumitra; RAJAGOPALAN, Srinivasan; BELAVAGI, Ningaraddi; RAMACHANDRA, Muralidhara Patent: WO2012/59932 A1, 2012 ; Location in patent: Page/Page column 112-113 ; WO 2012/059932 A1
  • Route2

    References

    • Pessoa-Mahana, David; Nunez, Andres; Espinosa, Christian; Mella-Raipan, Jaime; Pessoa-Mahana, Hernan Journal of the Brazilian Chemical Society, 2010 , vol. 21, # 1 p. 63 - 70

Safety Information

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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   69.85
  • LogP   0.7091
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   4

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