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CS-W001157 4
Total: USD 88.00

4-(4-Methylpiperazin-1-yl)phenylboronic acid

  • CAS No. 229009-40-9

  • Cat. No. CS-W003780
  • Purity≥97%
  • MDL No.MFCD11223486

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

4-(4-Methylpiperazin-1-yl)phenylboronic acid|CS-W003780

Structure of 229009-40-9

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General Information

  • CAS No. 229009-40-9
  • Cat. No. CS-W003780
  • Purity ≥97%
  • MDL No. MFCD11223486
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₇BN₂O₂
  • Molecular Weight 220.08
  • Synonym(s) Boronic acid, B-[4-(4-methyl-1-piperazinyl)phenyl]-
  • SMILES OB(c1ccc(cc1)N1CCN(CC1)C)O

Description

4-(4-Methylpiperazin-1-yl)phenylboronic acid features a boronate moiety linked to a para-substituted phenyl ring bearing a sterically hindered, electron-rich piperazine. This structure enables efficient Suzuki-Miyaura coupling under standard conditions, delivering biaryl architectures with high functional group tolerance and excellent stability during storage and handling.

Application

4-(4-Methylpiperazin-1-yl)phenylboronic acid serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, enabling efficient construction of biaryl scaffolds under mild conditions. The boronic acid functionality exhibits good bench stability and compatibility with diverse functional groups, facilitating straightforward purification and integration into complex molecular architectures. Its piperazine-based side chain provides enhanced solubility and potential for downstream derivatization in medicinal chemistry campaigns.

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

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Computational Chemistry Data

  • TPSA   46.94
  • LogP   -0.8818
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   2

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