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CS-W001157 4
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4-(4-Chlorophenoxy)phenylboronic acid

  • CAS No. 1035491-05-4

  • Cat. No. CS-0178570
  • Molecule weight248.47
  • Purity≥98%
  • MDL No.None

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

4-(4-Chlorophenoxy)phenylboronic acid|CS-0178570

Structure of 1035491-05-4

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General Information

  • CAS No. 1035491-05-4
  • Cat. No. CS-0178570
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₀BClO₃
  • Molecular Weight 248.47
  • Synonym(s) [4-(4-Chlorophenoxy)phenyl]boronic acid
  • SMILES OB(C1=CC=C(OC2=CC=C(Cl)C=C2)C=C1)O

Description

4-(4-Chlorophenoxy)phenylboronic acid features a boronic acid group linked to a phenoxy-substituted aryl scaffold, enabling efficient Suzuki-Miyaura cross-coupling reactions. The electron-withdrawing chlorine imparts enhanced stability and reactivity in palladium-catalyzed transformations. This bench-stable reagent integrates readily into complex molecule synthesis, particularly in pharmaceutical and agrochemical discovery workflows.

Application

4-(4-Chlorophenoxy)phenylboronic acid serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, enabling efficient construction of biaryl scaffolds. Its stability under ambient conditions and tolerance to diverse functional groups facilitate straightforward purification and integration into complex molecular architectures. The ortho-chlorine substituent provides additional handle for downstream derivatization, enhancing its utility in medicinal chemistry and materials science applications.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   49.69
  • LogP   1.8121
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   3

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