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1-Bromo-2-cyclopropoxybenzene

  • CAS No. 38380-86-8

  • Cat. No. CS-0129921
  • Purity≥96%
  • MDL No.MFCD17000488

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

1-Bromo-2-cyclopropoxybenzene|CS-0129921

Structure of 38380-86-8

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General Information

  • CAS No. 38380-86-8
  • Cat. No. CS-0129921
  • Purity ≥96%
  • MDL No. MFCD17000488
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉BrO
  • Molecular Weight 213.07
  • Synonym(s) 1-broMo-2-cyclopropyloxybenzene
  • SMILES BrC1=CC=CC=C1OC2CC2

Description

1-Bromo-2-cyclopropoxybenzene features a cyclopropoxy group ortho to bromine on a benzene ring, delivering a sterically constrained, electron-rich aryl halide. This configuration enables efficient coupling in cross-coupling reactions, particularly under palladium catalysis. The compound exhibits bench-stable handling and compatibility with diverse reaction conditions.

Application

1-Bromo-2-cyclopropoxybenzene serves as a versatile aryl halide building block for palladium-catalyzed cross-coupling reactions, enabling efficient construction of biaryl and heteroaryl scaffolds. The cyclopropoxy group imparts enhanced stability and favorable solubility, facilitating straightforward purification and compatibility with diverse functional groups under standard reaction conditions.

Synthesis

  • Route1
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    • ~%
    • In-stock
      1-Bromo-2-cyclopropoxybenzene|CS-0129921
      38380-86-8

    References

    • Chiu, George; Li, Shengjian; Connolly, Peter J.; Pulito, Virginia; Liu, Jingchun; Middleton, Steven A. Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 14 p. 3930 - 3934

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   9.23
  • LogP   2.9903
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   2

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