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CS-W001157 4
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1-(2-Chloropyrimidin-4-yl)piperidine-4-carboxylic acid

  • CAS No. 1208087-83-5

  • Cat. No. CS-0155580
  • Purity≥98%
  • MDL No.MFCD11040198

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

1-(2-Chloropyrimidin-4-yl)piperidine-4-carboxylic acid|CS-0155580

Structure of 1208087-83-5

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General Information

  • CAS No. 1208087-83-5
  • Cat. No. CS-0155580
  • Purity ≥98%
  • MDL No. MFCD11040198
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂ClN₃O₂
  • Molecular Weight 241.67
  • Synonym(s) 1-(2-Chloro-4-pyrimidinyl)-4-piperidinecarboxylic Acid
  • SMILES C1=CN=C(Cl)N=C1N2CCC(CC2)C(=O)O

Description

This piperidine-based scaffold integrates a 2-chloropyrimidin-4-yl group, delivering enhanced electrophilic reactivity and metabolic stability. The carboxylic acid functionality enables direct conjugation or salt formation, supporting efficient derivatization in medicinal chemistry campaigns. Designed for robust performance under standard bench conditions.

Application

1-(2-Chloropyrimidin-4-yl)piperidine-4-carboxylic acid serves as a versatile building block for the synthesis of bioactive heterocycles, particularly in medicinal chemistry and agrochemical research. The molecule combines a reactive 2-chloropyrimidine moiety with a piperidine carboxylic acid scaffold, enabling efficient coupling reactions via nucleophilic substitution or amide formation. Its bench-stable nature, predictable reactivity, and compatibility with standard purification methods make it well-suited for modular synthesis workflows.

Synthesis

  • Route1

    References

    • MSD OSS B.V.; HUISMAN, Ines; VAN DER STELT, Marcelis; WIEDENHOF, Wouter; BAKER-GLENN, Charles, Anthony, Graham; BLACKABY, Wesley, Peter; TRIVEDI, Naimisha Patent: WO2013/41457 A1, 2013 ;

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-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   66.32
  • LogP   1.431
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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