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CS-W001157 4
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Methyl 3-bromobicyclo[1.1.1]pentane-1-carboxylate

  • CAS No. 83249-14-3

  • Cat. No. CS-0049108
  • Purity≥95%
  • MDL No.None

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

Methyl 3-bromobicyclo[1.1.1]pentane-1-carboxylate|CS-0049108

Structure of 83249-14-3

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General Information

  • CAS No. 83249-14-3
  • Cat. No. CS-0049108
  • Purity ≥95%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉BrO₂
  • Molecular Weight 205.05
  • Synonym(s) Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-bromo-, methyl ester
  • SMILES COC(=O)C12CC(Br)(C1)C2

Description

Methyl 3-bromobicyclo[1.1.1]pentane-1-carboxylate delivers a rigid, strain-promoted scaffold ideal for rapid C–C bond formation. The bromide moiety enables efficient cross-coupling, while the bicyclic core provides exceptional stability and predictable reactivity under standard conditions. This compound integrates seamlessly into complex molecular architectures.

Application

Methyl 3-bromobicyclo[1.1.1]pentane-1-carboxylate serves as a versatile, bench-stable building block for constructing strained bicyclic architectures. Its tertiary bromide enables efficient nucleophilic substitution reactions, facilitating rapid access to diverse functionalized derivatives. The molecule's rigid framework and excellent functional group tolerance make it ideal for applications in medicinal chemistry and materials science, particularly in the synthesis of complex heterocycles and bioactive scaffolds via standard coupling protocols.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   1.477
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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