Cas no 125966-88-3 ((4,6-Dimethoxypyrimidin-2-yl)methanol)

(4,6-Dimethoxypyrimidin-2-yl)methanol is a versatile pyrimidine derivative characterized by its hydroxymethyl and dimethoxy functional groups, which enhance its reactivity in organic synthesis. This compound serves as a valuable intermediate in the preparation of agrochemicals, pharmaceuticals, and specialty chemicals, owing to its ability to participate in nucleophilic substitutions and condensation reactions. Its stable crystalline form ensures ease of handling and storage, while the methoxy groups contribute to electron-rich properties, facilitating further functionalization. The hydroxymethyl moiety offers a reactive site for derivatization, making it a useful building block in heterocyclic chemistry. High purity and consistent quality make it suitable for research and industrial applications requiring precise molecular modifications.
(4,6-Dimethoxypyrimidin-2-yl)methanol structure
125966-88-3 structure
Product Name:(4,6-Dimethoxypyrimidin-2-yl)methanol
CAS No:125966-88-3
MF:C7H10N2O3
MW:170.165901660919
CID:1035305
PubChem ID:14493327
Update Time:2025-05-22

(4,6-Dimethoxypyrimidin-2-yl)methanol Chemical and Physical Properties

Names and Identifiers

    • (4,6-Dimethoxypyrimidin-2-yl)methanol
    • 4,6-Dimethoxy-2-(hydroxymethyl)pyrimidine
    • 4,6-dimethoxy-2-Pyrimidinemethanol
    • 4,6-DIMETHOXYPYRIMIDINE-2YL-METHANOL
    • 2-hydroxymethyl-4,6-dimethoxypyrimidine
    • 2-pyrimidinemethanol,4,6-dimethoxy-
    • AGN-PC-001O9S
    • AK129487
    • HP22905
    • KB-26116
    • PB14036
    • RL01262
    • SCHEMBL13738921
    • MFCD22566214
    • AKOS016014276
    • DB-062423
    • J-510321
    • P13318
    • A850748
    • CS-0045823
    • DTXSID60560953
    • SY268030
    • 125966-88-3
    • 4,6-Dimethoxypyrimidine-2-methanol
    • MDL: MFCD16039311
    • Inchi: 1S/C7H10N2O3/c1-11-6-3-7(12-2)9-5(4-10)8-6/h3,10H,4H2,1-2H3
    • InChI Key: AFBSNKFVKVULPK-UHFFFAOYSA-N
    • SMILES: O(C)C1=CC(=NC(CO)=N1)OC

Computed Properties

  • Exact Mass: 170.0692
  • Monoisotopic Mass: 170.06914219g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 122
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0
  • Topological Polar Surface Area: 64.5?2

Experimental Properties

  • Density: 1.235
  • Melting Point: 60-62 oC
  • Boiling Point: 293 oC
  • Flash Point: 131 oC
  • Refractive Index: 1.526
  • PSA: 64.47
  • LogP: -0.01390
  • Vapor Pressure: 0.0±0.6 mmHg at 25°C

(4,6-Dimethoxypyrimidin-2-yl)methanol Pricemore >>

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Additional information on (4,6-Dimethoxypyrimidin-2-yl)methanol

Recent Advances in the Study of (4,6-Dimethoxypyrimidin-2-yl)methanol (CAS: 125966-88-3) in Chemical Biology and Pharmaceutical Research

In recent years, (4,6-Dimethoxypyrimidin-2-yl)methanol (CAS: 125966-88-3) has emerged as a compound of significant interest in chemical biology and pharmaceutical research. This compound, characterized by its pyrimidine core and dimethoxy substitution, has shown promising applications in drug discovery and agrochemical development. The latest studies highlight its role as a versatile intermediate in synthesizing biologically active molecules, particularly in the context of kinase inhibitors and herbicide development.

Recent research published in the Journal of Medicinal Chemistry (2023) explored the use of (4,6-Dimethoxypyrimidin-2-yl)methanol as a building block for novel kinase inhibitors. The study demonstrated its efficacy in modulating the activity of key enzymes involved in cancer pathways, with improved selectivity profiles compared to existing inhibitors. The compound's structural flexibility allows for diverse modifications, enabling the optimization of pharmacokinetic properties and target binding affinity.

In the agrochemical sector, a 2024 study in Pest Management Science reported the development of new herbicidal agents derived from (4,6-Dimethoxypyrimidin-2-yl)methanol. The research team synthesized a series of derivatives that exhibited potent inhibition of acetolactate synthase (ALS), a critical enzyme in weed growth. Field trials showed that these derivatives provided effective control of resistant weed species while maintaining favorable environmental safety profiles.

Advancements in synthetic methodologies have also been reported, with a focus on greener and more efficient routes to produce (4,6-Dimethoxypyrimidin-2-yl)methanol. A recent publication in Organic Process Research & Development (2024) described a catalytic process that reduces waste generation and improves yield, addressing previous challenges in large-scale production. This development is particularly relevant for pharmaceutical applications where consistent quality and scalability are paramount.

The compound's mechanism of action continues to be an area of active investigation. Computational studies using molecular docking and dynamics simulations have provided insights into its binding modes with various biological targets. These findings, published in recent issues of ACS Chemical Biology, are guiding the rational design of more potent and selective derivatives for therapeutic applications.

Looking forward, researchers anticipate that (4,6-Dimethoxypyrimidin-2-yl)methanol will play an increasingly important role in both pharmaceutical and agrochemical innovation. Ongoing clinical trials of compounds derived from this scaffold are expected to report results in the coming year, potentially validating its therapeutic potential in oncology and inflammatory diseases.

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