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CS-W001157 4
Total: USD 88.00

(4'-Butyl-3-fluoro-[1,1'-biphenyl]-4-yl)boronic acid

  • CAS No. 1400809-84-8

  • Cat. No. CS-0152348
  • Purity≥97%
  • MDL No.MFCD10687140

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

(4'-Butyl-3-fluoro-[1,1'-biphenyl]-4-yl)boronic acid|CS-0152348

Structure of 1400809-84-8

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General Information

  • CAS No. 1400809-84-8
  • Cat. No. CS-0152348
  • Purity ≥97%
  • MDL No. MFCD10687140
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₈BFO₂
  • Molecular Weight 272.12
  • Synonym(s) 3-Fluoro-4'-butyl-4-biphenylboronic acid
  • SMILES CCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)B(O)O)F

Description

This boronate reagent features a para-butyl and meta-fluoro substituted biphenyl core, enabling efficient cross-coupling under standard conditions. The electron-deficient aryl boronate integrates seamlessly into Suzuki-Miyaura reactions, delivering high functional group tolerance and stability during synthesis workflows.

Application

(4'-Butyl-3-fluoro-[1,1'-biphenyl]-4-yl)boronic acid serves as a versatile building block in Suzuki-Miyaura coupling reactions, enabling efficient construction of biaryl scaffolds with enhanced lipophilicity and metabolic stability. The butyl substituent improves solubility and processability, while the fluorine atom provides orthogonal reactivity and favorable electronic effects. Bench-stable and compatible with a wide range of functional groups, it facilitates streamlined synthesis of complex heterocycles and drug candidates in medicinal chemistry workflows.

Safety Information

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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   40.46
  • LogP   2.5151
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   5

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