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CS-W001157 4
Total: USD 88.00

3-(4-Methylpiperazin-1-yl)benzoic acid

  • CAS No. 215309-01-6

  • Cat. No. CS-W003336
  • Purity≥98%
  • MDL No.MFCD06742238

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

3-(4-Methylpiperazin-1-yl)benzoic acid|CS-W003336

Structure of 215309-01-6

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General Information

  • CAS No. 215309-01-6
  • Cat. No. CS-W003336
  • Purity ≥98%
  • MDL No. MFCD06742238
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆N₂O₂
  • Molecular Weight 220.27
  • Synonym(s) 3-(4-Methylpiperazin-1-yl)Benz
  • SMILES CN1CCN(C2=CC=CC(C(O)=O)=C2)CC1

Synthesis

  • Route1
    • 1-(3-Carbomethoxyphenyl)-4-methylpiperazine|CS-0204318
      474334-89-9
    • ~%
    • In-stock
      3-(4-Methylpiperazin-1-yl)benzoic acid|CS-W003336
      215309-01-6

    References

    • WO2008/107368 A1, ; Page/Page column 53 ; WO 2008/107368 A1
  • Route2
    • null|null
      251457-29-1
    • ~%
    • In-stock
      3-(4-Methylpiperazin-1-yl)benzoic acid|CS-W003336
      215309-01-6

    References

    • US6518267 B1, ; US 6518267 B1
  • Route3
    • null|null
      849753-22-6
    • ~%
    • In-stock
      3-(4-Methylpiperazin-1-yl)benzoic acid|CS-W003336
      215309-01-6

    References

    • European Journal of Medicinal Chemistry, , vol. 39, # 4 p. 305 - 321

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   43.78
  • LogP   1.1366
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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