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CS-W001157 4
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tert-Butyl cis-3-fluoro-4-hydroxypyrrolidine-1-carboxylate

  • CAS No. 1174020-48-4

  • Cat. No. CS-0036067
  • Purity≥97%
  • MDL No.None

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

tert-Butyl cis-3-fluoro-4-hydroxypyrrolidine-1-carboxylate|CS-0036067

Structure of 1174020-48-4

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General Information

  • CAS No. 1174020-48-4
  • Cat. No. CS-0036067
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₆FNO₃
  • Molecular Weight 205.23
  • Synonym(s) cis-3-fluoro-4-hydoxy-n- boc pyrroldine
  • SMILES CC(C)(C)OC(=O)N1C[C@@H]([C@@H](C1)O)F

Description

This tert-butyl (3S,4R)-3-fluoro-4-hydroxypyrrolidine-1-carboxylate features a stereochemically defined fluorinated pyrrolidine core with a bench-stable tert-butyl ester handle. The 3-fluoro, 4-hydroxy motif enables direct incorporation into bioactive scaffolds requiring conformational restraint and enhanced metabolic stability. This derivative pairs well with coupling reactions under mild conditions, offering efficient access to fluorinated heterocycles in medicinal chemistry campaigns.

Application

tert-Butyl (3S,4R)-3-fluoro-4-hydroxypyrrolidine-1-carboxylate serves as a stereochemically defined building block for fluorinated pyrrolidine scaffolds. The hydroxyl group enables selective derivatization, while the tert-butyl carbamate offers stability and convenient removal under mild acidic conditions. This compound functions effectively in late-stage functionalization and supports the synthesis of bioactive heterocycles via standard coupling and cyclization 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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   49.77
  • LogP   0.9361
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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