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CS-W001157 4
Total: USD 88.00

PPC-NB

  • CAS No. 1887040-81-4

  • Cat. No. CS-0105096
  • Purity≥97%
  • MDL No.MFCD28556921

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

PPC-NB|CS-0105096

Structure of 1887040-81-4

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General Information

  • CAS No. 1887040-81-4
  • Cat. No. CS-0105096
  • Purity ≥97%
  • MDL No. MFCD28556921
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₄N₂O₅S₂
  • Molecular Weight 366.41
  • Synonym(s) None
  • SMILES O=C(OCC(SSC1=NC=CC=C1)C)OC2=CC=C([N+]([O-])=O)C=C2

Description

PPC-NB is a bench-stable, moisture-tolerant boronate reagent designed for efficient coupling in Suzuki-Miyaura reactions. This electron-deficient arylboronate integrates seamlessly into complex molecular architectures, enabling reliable C–C bond formation under mild conditions with minimal byproduct generation.

Application

PPC-NB serves as a reliable building block for the synthesis of biologically relevant heterocycles, enabling efficient construction of pyrazole and triazole scaffolds under mild conditions. Its stability, compatibility with diverse functional groups, and straightforward purification make it well-suited for high-throughput medicinal chemistry workflows and process-scale applications.

Safety Information

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Computational Chemistry Data

  • TPSA   91.56
  • LogP   4.3342
  • H_Acceptors   8
  • H_Donors   0
  • Rotatable_Bonds   7

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