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CS-W001157 4
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6-Aminopyrimidine-4-carboxylic acid

  • CAS No. 38214-46-9

  • Cat. No. CS-W005978
  • Purity≥98%
  • MDL No.MFCD07783937

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

6-Aminopyrimidine-4-carboxylic acid|CS-W005978

Structure of 38214-46-9

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General Information

  • CAS No. 38214-46-9
  • Cat. No. CS-W005978
  • Purity ≥98%
  • MDL No. MFCD07783937
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₅N₃O₂
  • Molecular Weight 139.11
  • Synonym(s) H-6APY4-OH
  • SMILES C1=C(C(O)=O)N=CN=C1N

Description

6-Aminopyrimidine-4-carboxylic acid features a dual functional group architecture with a nucleophilic amine and an electrophilic carboxylic acid positioned at opposite ends of the pyrimidine ring. This arrangement enables direct coupling in peptide-like syntheses or conjugation chemistries, offering a robust scaffold for medicinal chemistry applications. The molecule exhibits favorable solubility in aqueous and polar organic media under standard conditions.

Application

6-Aminopyrimidine-4-carboxylic acid serves as a versatile building block in medicinal chemistry, enabling the synthesis of pyrimidine-based scaffolds through standard coupling and functionalization reactions. Its dual functionality—amine and carboxylic acid—facilitates efficient derivatization via amide formation, amidation, or cyclization protocols. The compound exhibits good bench stability and is compatible with common protecting group strategies, supporting scalable synthesis and purification in routine laboratory workflows.

Synthesis

  • Route1
    • 6-Aminopyrimidine-4-carboxamide|CS-0971039
      81333-07-5
    • ~%
    • In-stock
      6-Aminopyrimidine-4-carboxylic acid|CS-W005978
      38214-46-9

    References

    • Bredereck et al. Chemische Berichte, 1956 , vol. 89, p. 12,14,17

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   89.1
  • LogP   -0.243
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   1

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