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CS-W001157 4
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Methyl 4-((4-methylpiperazin-1-yl)methyl)benzoate

  • CAS No. 314268-40-1

  • Cat. No. CS-0038767
  • Purity≥97%
  • MDL No.MFCD01467150

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

Methyl 4-((4-methylpiperazin-1-yl)methyl)benzoate|CS-0038767

Structure of 314268-40-1

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General Information

  • CAS No. 314268-40-1
  • Cat. No. CS-0038767
  • Purity ≥97%
  • MDL No. MFCD01467150
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₀N₂O₂
  • Molecular Weight 248.32
  • Synonym(s) Methyl 4-[(4-methylpiperazin-1-yl)methyl]benzoate
  • SMILES CN1CCN(CC1)CC2=CC=C(C=C2)C(=O)OC

Synthesis

  • Route1

    References

    • Koroleva, Elena V.; Kadutskii, Aleksey P.; Farina, Alexander V.; Ignatovich, Janna V.; Ermolinskaya, Anastasiya L.; Gusak, Klaudiya N.; Kalinichenko, Elena N. Tetrahedron Letters, 2012 , vol. 53, # 38 p. 5056 - 5058
  • Route2
    • In-stock
      N-Methylpiperazine|CS-0009394
      109-01-3
    • p-(Methoxycarbonyl)benzyl bromide|CS-W008845
      2417-72-3
    • ~70%
    • In-stock
      Methyl 4-((4-methylpiperazin-1-yl)methyl)benzoate|CS-0038767
      314268-40-1

    References

    • APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. Patent: WO2003/91249 A1, 2003 ; Location in patent: Page/Page column 21-22 ;
  • Route3

    References

    • WO2004/63191 A1, ; Page 8; 74 ;

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   32.78
  • LogP   1.2206
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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