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CS-W001157 4
Total: USD 88.00

(2-Amino-4-(methoxycarbonyl)phenyl)boronic acid hydrochloride

  • CAS No. 380430-55-7

  • Cat. No. CS-0041821
  • Purity≥95%
  • MDL No.MFCD02258941

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

(2-Amino-4-(methoxycarbonyl)phenyl)boronic acid hydrochloride|CS-0041821

Structure of 380430-55-7

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General Information

  • CAS No. 380430-55-7
  • Cat. No. CS-0041821
  • Purity ≥95%
  • MDL No. MFCD02258941
  • Storage RT, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₁BClNO₄
  • Molecular Weight 231.44
  • Synonym(s) 2-Amino-4-(methoxycarbonyl)benzeneboronic Acid Hydrochloride (contains varying amounts of Anhydride)
  • SMILES OB(C1=CC=C(C(OC)=O)C=C1N)O.[H]Cl

Description

This boronic acid derivative features a methoxycarbonyl group and an amino substituent, enhancing solubility and reactivity in Suzuki-Miyaura coupling reactions. The hydrochloride salt form improves stability and handling under standard conditions.

Application

(2-Amino-4-(methoxycarbonyl)phenyl)boronic acid hydrochloride serves as a versatile building block in Suzuki-Miyaura coupling reactions, enabling efficient C–C bond formation under mild conditions. The amino and ester functionalities provide orthogonal reactivity for downstream modifications, while the boronic acid moiety offers excellent bench stability and ease of purification. This compound functions reliably in the synthesis of biaryl scaffolds and functionalized heterocycles relevant to medicinal chemistry and materials science.

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   92.78
  • LogP   -0.843
  • H_Acceptors   5
  • H_Donors   3
  • Rotatable_Bonds   2

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