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CS-W001157 4
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1-(1,1-Dimethylethyl) 4-(4-boronobenzoyl)-1-piperazinecarboxylate

  • CAS No. 1150114-76-3

  • Cat. No. CS-W000858
  • Purity≥95%
  • MDL No.MFCD12025996

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

1-(1,1-Dimethylethyl) 4-(4-boronobenzoyl)-1-piperazinecarboxylate|CS-W000858

Structure of 1150114-76-3

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General Information

  • CAS No. 1150114-76-3
  • Cat. No. CS-W000858
  • Purity ≥95%
  • MDL No. MFCD12025996
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₂₃BN₂O₅
  • Molecular Weight 334.18
  • Synonym(s) None
  • SMILES O=C(OC(C)(C)C)N1CCN(C(=O)C2=CC=C(C=C2)B(O)O)CC1

Description

This piperazinecarboxylate derivative features a boronate ester group for facile Suzuki-Miyaura coupling, paired with a tert-butyl-protected amine. It integrates readily into bioconjugation workflows and offers enhanced stability under standard handling conditions.

Application

1-(1,1-Dimethylethyl) 4-(4-boronobenzoyl)-1-piperazinecarboxylate serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, enabling efficient C–C bond formation under mild conditions. The boronate ester group exhibits excellent stability and functional group tolerance, while the piperazine-carboxylate motif provides a polar, solubilizing handle ideal for medicinal chemistry applications. Its bench-stable nature and compatibility with standard reaction protocols facilitate straightforward purification and integration into complex molecular architectures.

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

Quality Control

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Computational Chemistry Data

  • TPSA   90.31
  • LogP   0.0593
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   2

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