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CS-W001157 4
Total: USD 88.00

(4-Chloro-3-cyanophenyl)boronic acid

  • CAS No. 871332-95-5

  • Cat. No. CS-W008298
  • Purity≥98%
  • MDL No.MFCD08056360

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

(4-Chloro-3-cyanophenyl)boronic acid|CS-W008298

Structure of 871332-95-5

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General Information

  • CAS No. 871332-95-5
  • Cat. No. CS-W008298
  • Purity ≥98%
  • MDL No. MFCD08056360
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅BClNO₂
  • Molecular Weight None
  • Synonym(s) 4-Chloro-3-cyanophenylboronic acid
  • SMILES OB(C1=CC=C(Cl)C(C#N)=C1)O

Description

This boronic acid features a chlorine-substituted phenyl ring paired with a cyano group, enabling selective coupling in Suzuki-Miyaura reactions. The electron-deficient aryl system enhances reactivity, while the stable boronate moiety facilitates handling under standard conditions.

Application

(4-Chloro-3-cyanophenyl)boronic acid serves as a versatile building block in Suzuki-Miyaura coupling reactions, enabling efficient C–C bond formation under mild conditions. The molecule combines a boronic acid handle with complementary electron-withdrawing groups—chloro and cyano—offering enhanced reactivity and stability for late-stage functionalization. Its bench-stable nature and tolerance to diverse reaction conditions make it ideal for constructing complex aryl scaffolds 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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