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CS-W001157 4
Total: USD 88.00

(5-(Methoxycarbonyl)thiophen-3-yl)boronic acid

  • CAS No. 957062-52-1

  • Cat. No. CS-0168552
  • Purity≥98%
  • MDL No.MFCD09800878

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

(5-(Methoxycarbonyl)thiophen-3-yl)boronic acid|CS-0168552

Structure of 957062-52-1

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General Information

  • CAS No. 957062-52-1
  • Cat. No. CS-0168552
  • Purity ≥98%
  • MDL No. MFCD09800878
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₇BO₄S
  • Molecular Weight 185.99
  • Synonym(s) Methyl 4-boronothiophene-2-carboxylate
  • SMILES O=C(C1=CC(B(O)O)=CS1)OC

Description

This boronic acid features a methoxycarbonyl-substituted thiophene core, offering enhanced solubility and stability in aqueous and polar organic media. The pendant boronic acid group enables efficient Suzuki-Miyaura cross-coupling reactions under mild conditions, facilitating rapid access to functionalized heteroaryl architectures in medicinal chemistry and materials synthesis.

Application

(5-(Methoxycarbonyl)thiophen-3-yl)boronic acid serves as a versatile building block for Suzuki-Miyaura cross-coupling reactions, enabling efficient construction of biaryl and heteroaryl architectures. The methoxycarbonyl group enhances solubility and facilitates downstream derivatization, while the boronic acid moiety exhibits good bench stability and functional group tolerance. Its utility in synthesizing pharmaceutically relevant thiophene-based scaffolds makes it a practical choice for medicinal chemistry and process development workflows.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   66.76
  • LogP   -0.7855
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   2

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