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CS-W001157 4
Total: USD 88.00

3-(Methylcarbamoyl)benzeneboronic acid

  • CAS No. 832695-88-2

  • Cat. No. CS-W000977
  • Purity≥98%
  • MDL No.MFCD04038918

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

3-(Methylcarbamoyl)benzeneboronic acid|CS-W000977

Structure of 832695-88-2

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General Information

  • CAS No. 832695-88-2
  • Cat. No. CS-W000977
  • Purity ≥98%
  • MDL No. MFCD04038918
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀BNO₃
  • Molecular Weight 178.98
  • Synonym(s) boronic acid, B-[3-[(methylamino)carbonyl]phenyl]-
  • SMILES CNC(=O)c1cccc(c1)B(O)O

Description

This boronic acid features a methylcarbamoyl group at the meta position, enhancing solubility and stability. The para-boronate moiety enables efficient Suzuki-Miyaura coupling under standard conditions, facilitating rapid access to functionalized biaryl scaffolds in medicinal chemistry and materials synthesis.

Application

3-(Methylcarbamoyl)benzeneboronic acid serves as a versatile building block in Suzuki-Miyaura coupling reactions, enabling efficient construction of biaryl scaffolds with retained functional group compatibility. The methylcarbamoyl group provides enhanced solubility and stability compared to unsubstituted analogs, while the boronic acid moiety facilitates reliable cross-coupling under standard conditions. This compound functions effectively in the synthesis of pharmaceutical intermediates and heterocyclic architectures requiring orthogonal reactivity.

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   69.56
  • LogP   -1.274
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   2

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