Cas no 127958-00-3 (2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid)

2-Amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid is a pyrimidine derivative with a methoxymethyl substituent at the 4-position and a carboxylic acid group at the 5-position. This compound serves as a versatile intermediate in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals. Its functional groups enable further derivatization, making it valuable for constructing complex heterocyclic frameworks. The presence of both amino and carboxylic acid moieties enhances its reactivity in condensation and cyclization reactions. The methoxymethyl group contributes to solubility and stability, facilitating its use in various synthetic pathways. This compound is typically handled under controlled conditions due to its reactivity and potential sensitivity to moisture or heat.
2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid structure
127958-00-3 structure
Product Name:2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid
CAS No:127958-00-3
MF:C7H9N3O3
MW:183.164661169052
MDL:MFCD16657435
CID:897666
PubChem ID:14639222
Update Time:2025-11-02

2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 5-Pyrimidinecarboxylic acid, 2-amino-4-(methoxymethyl)- (9CI)
    • 2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid
    • MDL: MFCD16657435
    • Inchi: 1S/C7H9N3O3/c1-13-3-5-4(6(11)12)2-9-7(8)10-5/h2H,3H2,1H3,(H,11,12)(H2,8,9,10)
    • InChI Key: MLTOOLRXORLYOJ-UHFFFAOYSA-N
    • SMILES: C1(N)=NC=C(C(O)=O)C(COC)=N1

Computed Properties

  • Exact Mass: 183.06400

Experimental Properties

  • PSA: 98.33000
  • LogP: 0.48460

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Additional information on 2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid

Comprehensive Guide to 2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid (CAS No. 127958-00-3): Properties, Applications, and Market Insights

2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid (CAS No. 127958-00-3) is a specialized pyrimidine derivative with significant potential in pharmaceutical and agrochemical research. This compound, characterized by its unique methoxymethyl and carboxylic acid functional groups, has garnered attention for its versatile applications. In this article, we delve into its chemical properties, synthesis methods, and emerging uses, while addressing common queries from researchers and industry professionals.

The molecular structure of 2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid features a pyrimidine ring substituted with an amino group at the 2-position, a methoxymethyl group at the 4-position, and a carboxylic acid at the 5-position. This arrangement contributes to its moderate polarity and water solubility, making it suitable for various biochemical applications. Recent studies highlight its role as a building block in the synthesis of heterocyclic compounds, particularly in drug discovery pipelines targeting enzyme inhibition.

One of the most searched questions about CAS No. 127958-00-3 revolves around its synthetic routes. The compound is typically prepared via multistep organic synthesis, starting from readily available pyrimidine precursors. A common approach involves the alkylation of 2-amino-4-chloropyrimidine-5-carboxylic acid followed by methoxymethylation. Researchers are increasingly exploring green chemistry alternatives to improve yield and reduce environmental impact—a hot topic in modern pharmaceutical manufacturing.

In pharmaceutical applications, 2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid serves as a key intermediate for small molecule drugs. Its structural motifs are found in compounds investigated for antiviral and anti-inflammatory properties, aligning with current global health trends. The carboxylic acid moiety allows for further derivatization, enabling the creation of prodrugs or bioconjugates. Notably, its potential in cancer research has been explored due to its ability to modulate kinase activity—a frequently searched term in medicinal chemistry databases.

The agrochemical industry also utilizes this compound as a precursor for crop protection agents. Its pyrimidine core is structurally similar to several herbicides and fungicides, driving demand in sustainable agriculture solutions. With the growing emphasis on food security and precision farming, researchers are investigating derivatives of CAS 127958-00-3 for targeted pest management—a topic frequently discussed in agricultural biotechnology forums.

From a market perspective, the global demand for 2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid reflects broader trends in fine chemicals consumption. Analytical reports indicate steady growth in the pharmaceutical intermediates sector, particularly in Asia-Pacific regions. Suppliers often highlight its high purity grades (≥98%) for research use, with custom synthesis services becoming increasingly popular—a response to the rise of personalized medicine and niche therapeutic development.

Storage and handling of CAS 127958-00-3 require standard laboratory precautions. The compound is typically stable at room temperature when kept in airtight containers away from moisture. Its spectral data (including NMR and HPLC profiles) are well-documented, facilitating quality control in industrial settings. These technical details are among the top search queries from quality assurance specialists and process chemists.

Innovation surrounding this compound continues to evolve. Recent patent literature reveals novel applications in material science, particularly as a ligand for metal-organic frameworks (MOFs)—a trending topic in nanotechnology circles. Additionally, its potential in diagnostic probe development is being explored, capitalizing on the fluorescence properties of pyrimidine derivatives. These cutting-edge applications position 2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid as a compound of interest in multidisciplinary research.

For researchers seeking analytical standards or bulk quantities of 127958-00-3, verification of certificates of analysis (CoA) is crucial. The compound's chromatographic purity and residual solvent levels are critical parameters, especially for GMP-compliant applications. These quality considerations dominate professional discussions in contract manufacturing organizations (CMOs) and regulatory affairs departments.

In conclusion, 2-amino-4-(methoxymethyl)pyrimidine-5-carboxylic acid (CAS No. 127958-00-3) represents a versatile chemical building block with expanding applications across multiple industries. Its relevance to drug discovery, sustainable agriculture, and advanced materials ensures continued scientific interest. As research progresses, this compound will likely play a pivotal role in addressing contemporary challenges in healthcare and environmental science, making it a valuable subject for ongoing investigation and commercial development.

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