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CS-W001157 4
Total: USD 88.00

2-Bromo-4-fluoroanisole

  • CAS No. 452-08-4

  • Cat. No. CS-W001094
  • Purity≥98%
  • MDL No.MFCD00012014

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

2-Bromo-4-fluoroanisole|CS-W001094

Structure of 452-08-4

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General Information

  • CAS No. 452-08-4
  • Cat. No. CS-W001094
  • Purity ≥98%
  • MDL No. MFCD00012014
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆BrFO
  • Molecular Weight 205.03
  • Synonym(s) None
  • SMILES COC1=C(Br)C=C(F)C=C1

Description

2-Bromo-4-fluoroanisole was used in the synthesis of (5-fluoro-2-methoxyphenyl)methanol.

Application

2-Bromo-4-fluoroanisole serves as a versatile aryl building block in cross-coupling reactions, enabling efficient construction of biaryl scaffolds under palladium-catalyzed conditions. The ortho-bromo and meta-fluoro substituents provide complementary reactivity for sequential functionalization, while the methoxy group enhances solubility and offers a handle for orthogonal transformations. Its bench-stable nature and compatibility with standard coupling protocols make it a practical choice for medicinal chemistry and process development workflows.

Synthesis

  • Route1
    • In-stock
      2-Bromo-4-fluorophenol|CS-W003971
      496-69-5
    • null|null
      74-88-4
    • ~94%
    • In-stock
      2-Bromo-4-fluoroanisole|CS-W001094
      452-08-4

    References

    • Gu, Shuang-Xi; Zhang, Xuan; He, Qiu-Qin; Yang, Liu-Meng; Ma, Xiao-Dong; Zheng, Yong-Tang; Yang, Shi-Qiong; Chen, Fen-Er Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 14 p. 4220 - 4226
  • Route2

    References

    • Castellonese, Paul; Villa, Pierre Helvetica Chimica Acta, 1983 , vol. 66, # 4 p. 1068 - 1077
  • Route3

    References

    • Finger et al. Journal of the American Chemical Society, 1959 , vol. 81, p. 94,95, 97

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   9.23
  • LogP   2.5968
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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