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2-(3-Fluorobicyclo[1.1.1]pentan-1-yl)acetic acid

  • CAS No. 2092067-90-6

  • Cat. No. CS-0432686
  • Purity≥98%
  • MDL No.None

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

2-(3-Fluorobicyclo[1.1.1]pentan-1-yl)acetic acid|CS-0432686

Structure of 2092067-90-6

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General Information

  • CAS No. 2092067-90-6
  • Cat. No. CS-0432686
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉FO₂
  • Molecular Weight 144.14
  • Synonym(s) 2-{3-fluorobicyclo[1.1.1]pentan-1-yl}acetic acid
  • SMILES O=C(O)CC1(C2)CC2(F)C1

Description

This bicyclic carboxylic acid integrates a fluorinated cage structure that enhances metabolic stability and modulates lipophilicity. The 3-fluorobicyclo[1.1.1]pentane motif imparts rigidity and improved membrane permeability, enabling efficient incorporation into bioactive molecules.

Application

2-(3-Fluorobicyclo[1.1.1]pentan-1-yl)acetic acid serves as a versatile building block for the synthesis of fluorinated bioactive molecules, leveraging the rigidity and metabolic stability imparted by the bicyclo[1.1.1]pentane core. The carboxylic acid functionality enables direct derivatization or incorporation into peptide mimetics and heterocyclic scaffolds, while the fluorine substituent enhances lipophilicity and modulates electronic properties. Bench-stable and compatible with standard coupling protocols, it facilitates efficient access to diverse compound libraries in medicinal chemistry applications.

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H315-H318-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   37.3
  • LogP   1.3533
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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