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CS-W001157 4
Total: USD 88.00

(3-Fluoro-5-(methoxycarbonyl)phenyl)boronic acid

  • CAS No. 871329-62-3

  • Cat. No. CS-0067554
  • Purity≥98%
  • MDL No.MFCD07363749

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

(3-Fluoro-5-(methoxycarbonyl)phenyl)boronic acid|CS-0067554

Structure of 871329-62-3

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General Information

  • CAS No. 871329-62-3
  • Cat. No. CS-0067554
  • Purity ≥98%
  • MDL No. MFCD07363749
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈BFO₄
  • Molecular Weight 197.96
  • Synonym(s) 3-Fluoro-5-methoxycarbonylphenylboronic acid
  • SMILES OB(O)C1=CC(F)=CC(C(OC)=O)=C1

Description

This boronic acid features a fluorinated aryl core paired with a methoxycarbonyl group, enabling selective coupling in Suzuki-Miyaura reactions. The electron-withdrawing fluorine enhances reactivity while the ester functionality offers tunable stability and compatibility under standard conditions.

Application

(3-Fluoro-5-(methoxycarbonyl)phenyl)boronic acid serves as a versatile building block in Suzuki-Miyaura coupling reactions, enabling efficient C–C bond formation under mild conditions. The ortho-fluorine and ester functionalities provide orthogonal reactivity for downstream modifications, while the boronic acid moiety offers excellent bench stability and ease of purification. This compound is particularly valuable in constructing substituted heterocycles and biaryl architectures common in pharmaceutical synthesis.

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   66.76
  • LogP   -0.7079
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   2

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