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CS-W001157 4
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(2-Chloro-5-cyanophenyl)boronic acid

  • CAS No. 936249-33-1

  • Cat. No. CS-0112884
  • Molecule weight181.38
  • Purity≥98%
  • MDL No.MFCD06656271

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

(2-Chloro-5-cyanophenyl)boronic acid|CS-0112884

Structure of 936249-33-1

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General Information

  • CAS No. 936249-33-1
  • Cat. No. CS-0112884
  • Purity ≥98%
  • MDL No. MFCD06656271
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅BClNO₂
  • Molecular Weight 181.38
  • Synonym(s) Boronic acid, B-(2-chloro-5-cyanophenyl)-
  • SMILES N#CC1=CC=C(Cl)C(B(O)O)=C1

Description

This boronate moiety integrates a chloro and cyano group at ortho positions, enabling selective cross-coupling under standard conditions. The electron-deficient aryl system enhances reactivity in Suzuki-Miyaura transformations while maintaining bench-stable handling.

Application

(2-Chloro-5-cyanophenyl)boronic acid serves as a versatile building block in palladium-catalyzed cross-coupling reactions, enabling efficient C–C bond formation under standard Suzuki-Miyaura conditions. The pendant chloro and cyano groups provide orthogonal reactivity for downstream functionalization, while the boronic acid moiety offers excellent bench stability and ease of purification. Its compatibility with diverse reaction partners makes it a reliable scaffold for constructing complex aryl architectures in medicinal chemistry and materials science applications.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P260-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   64.25
  • LogP   -0.10852
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   1

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