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CS-W001157 4
Total: USD 88.00

3-Bromo-1,1-difluorocyclobutane

  • CAS No. 1310729-91-9

  • Cat. No. CS-0045554
  • Purity≥97%
  • MDL No.None

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

3-Bromo-1,1-difluorocyclobutane|CS-0045554

Structure of 1310729-91-9

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General Information

  • CAS No. 1310729-91-9
  • Cat. No. CS-0045554
  • Purity ≥97%
  • MDL No. None
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₅BrF₂
  • Molecular Weight 170.98
  • Synonym(s) 1-bromo-3,3-difluorocyclobutane
  • SMILES FC1(F)CC(Br)C1

Description

3-Bromo-1,1-difluorocyclobutane features a strained cyclobutane ring bearing bromine and two fluorine atoms at adjacent positions, enabling unique reactivity in synthetic transformations. This bench-stable, moisture-tolerant molecule integrates readily into fluorinated scaffolds for medicinal chemistry applications.

Application

3-Bromo-1,1-difluorocyclobutane serves as a versatile building block in medicinal chemistry, enabling the introduction of both bromine and difluoromethylene motifs within cyclobutane scaffolds. Its stability under standard synthetic conditions facilitates subsequent cross-coupling reactions, while the geminal difluoro group enhances metabolic resistance and modulates electronic properties. The molecule functions effectively in transition-metal-catalyzed transformations and provides access to fluorinated heterocycles and bioactive analogs relevant to drug discovery pipelines.

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-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   0
  • LogP   2.179
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   0

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