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CS-W001157 4
Total: USD 88.00

(3-Methoxy-4-(methoxycarbonyl)phenyl)boronic acid

  • CAS No. 603122-41-4

  • Cat. No. CS-0047532
  • Purity≥97%
  • MDL No.MFCD07366483

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

(3-Methoxy-4-(methoxycarbonyl)phenyl)boronic acid|CS-0047532

Structure of 603122-41-4

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General Information

  • CAS No. 603122-41-4
  • Cat. No. CS-0047532
  • Purity ≥97%
  • MDL No. MFCD07366483
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁BO₅
  • Molecular Weight 209.99
  • Synonym(s) benzoic acid, 4-borono-2-methoxy-, methyl ester
  • SMILES COC1=C(C(OC)=O)C=CC(B(O)O)=C1

Description

This boronic acid features a methoxy-substituted aromatic ring paired with a methoxycarbonyl group, enhancing solubility and stability. The pendant boronic acid moiety enables efficient Suzuki-Miyaura coupling under standard conditions, facilitating rapid assembly of complex aryl architectures in synthetic and medicinal chemistry workflows.

Application

(3-Methoxy-4-(methoxycarbonyl)phenyl)boronic acid serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, enabling efficient construction of biaryl and heteroaryl scaffolds. Its stability under ambient conditions, combined with excellent functional group tolerance and straightforward purification, makes it well-suited for iterative synthesis in medicinal chemistry and materials science applications.

Synthesis

  • Route1

    References

    • US2004/6143 A1, ; US 20040006143 A1

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   75.99
  • LogP   -0.8384
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   3

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