Cas no 2225179-85-9 (2-(n-Propoxy)pyrimidine-5-boronic acid)
2-(n-Propoxy)pyrimidine-5-boronic acid Chemical and Physical Properties
Names and Identifiers
-
- 2-(n-Propoxy)pyrimidine-5-boronic acid
- (2-PROPOXYPYRIMIDIN-5-YL)BORONIC ACID
- AB41269
- AKOS006286817
- 2225179-85-9
-
- Inchi: 1S/C7H11BN2O3/c1-2-3-13-7-9-4-6(5-10-7)8(11)12/h4-5,11-12H,2-3H2,1H3
- InChI Key: ZLKBIZWGWWVVJF-UHFFFAOYSA-N
- SMILES: C1(OCCC)=NC=C(B(O)O)C=N1
Computed Properties
- Exact Mass: 182.0862724g/mol
- Monoisotopic Mass: 182.0862724g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 140
- 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
- Topological Polar Surface Area: 75.5?2
2-(n-Propoxy)pyrimidine-5-boronic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | P903996-5mg |
2-(n-Propoxy)pyrimidine-5-boronic acid |
2225179-85-9 | 95% | 5mg |
¥959.40 | 2022-09-01 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | P903996-25mg |
2-(n-Propoxy)pyrimidine-5-boronic acid |
2225179-85-9 | 95% | 25mg |
¥2,880.00 | 2022-09-01 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | P903996-100mg |
2-(n-Propoxy)pyrimidine-5-boronic acid |
2225179-85-9 | 95% | 100mg |
¥8,640.00 | 2022-09-01 |
2-(n-Propoxy)pyrimidine-5-boronic acid Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
Additional information on 2-(n-Propoxy)pyrimidine-5-boronic acid
Comprehensive Guide to 2-(n-Propoxy)pyrimidine-5-boronic acid (CAS No. 2225179-85-9): Properties, Applications, and Market Insights
2-(n-Propoxy)pyrimidine-5-boronic acid (CAS No. 2225179-85-9) is a specialized boronic acid derivative widely used in pharmaceutical research, agrochemical development, and material science. This compound belongs to the pyrimidine boronic acid family, known for its versatility in Suzuki-Miyaura cross-coupling reactions, a cornerstone of modern organic synthesis. With the growing demand for heterocyclic building blocks in drug discovery, this compound has gained significant attention from researchers and manufacturers alike.
The molecular structure of 2-(n-Propoxy)pyrimidine-5-boronic acid features a pyrimidine core substituted with a propoxy group at the 2-position and a boronic acid moiety at the 5-position. This unique arrangement makes it particularly valuable for constructing complex molecular architectures. Recent studies highlight its importance in developing kinase inhibitors and anticancer agents, addressing one of the most searched topics in medicinal chemistry: "novel cancer treatment compounds."
In the context of green chemistry trends, researchers are increasingly interested in 2-(n-Propoxy)pyrimidine-5-boronic acid due to its role in creating more efficient synthetic pathways. The compound's stability under various reaction conditions makes it ideal for sustainable pharmaceutical manufacturing, a hot topic in 2024 as the industry moves toward environmentally friendly processes. Its application in flow chemistry systems has been particularly noteworthy, answering frequent search queries about "continuous flow synthesis building blocks."
The global market for pyrimidine boronic acids has seen steady growth, with 2-(n-Propoxy)pyrimidine-5-boronic acid maintaining a significant share. Pharmaceutical companies value this compound for its high purity standards and consistent batch-to-batch quality, crucial factors in drug development. Market analysts note increased demand from Asia-Pacific regions, particularly for small molecule drug discovery applications, reflecting the booming pharmaceutical sector in these areas.
From a technical perspective, 2-(n-Propoxy)pyrimidine-5-boronic acid demonstrates excellent solubility in common organic solvents like DMSO and THF, while maintaining stability in aqueous solutions at specific pH ranges. These properties make it particularly useful for high-throughput screening applications, addressing another frequently searched term in chemical databases. The compound's crystalline form ensures easy handling and storage, with manufacturers typically providing detailed technical data sheets that include comprehensive spectroscopic characterization data.
Recent advancements in catalytic systems have further enhanced the utility of 2-(n-Propoxy)pyrimidine-5-boronic acid in metal-catalyzed reactions. Researchers are particularly excited about its performance in palladium-catalyzed couplings under mild conditions, a topic generating numerous academic publications and patent applications. This aligns with current industry searches for "mild condition cross-coupling reagents" and "air-stable boronic acid derivatives."
Quality control measures for 2-(n-Propoxy)pyrimidine-5-boronic acid typically involve advanced analytical techniques including HPLC purity analysis, 1H/13C NMR verification, and mass spectrometry. Reputable suppliers provide certificates of analysis that detail these parameters, responding to the growing market demand for well-characterized synthetic building blocks. The compound's shelf life and storage recommendations (typically under inert atmosphere at low temperatures) are frequently searched parameters by laboratory purchasers.
Looking toward future applications, 2-(n-Propoxy)pyrimidine-5-boronic acid shows promise in emerging fields like proteolysis targeting chimeras (PROTACs) development and covalent inhibitor design. These cutting-edge therapeutic approaches have generated substantial interest in scientific communities, as evidenced by search trends for "next-generation drug modalities." The compound's molecular features make it suitable for constructing the linker components in these complex systems.
For researchers considering 2-(n-Propoxy)pyrimidine-5-boronic acid for their projects, numerous published protocols demonstrate its successful application in multi-step syntheses. The scientific literature contains examples of its use in creating biologically active molecules, particularly in medicinal chemistry programs targeting central nervous system disorders and metabolic diseases. These applications correspond to trending searches in academic databases for "CNS drug building blocks" and "metabolic disease research chemicals."
In conclusion, 2-(n-Propoxy)pyrimidine-5-boronic acid (CAS No. 2225179-85-9) represents a valuable tool for modern chemical research and development. Its combination of structural features, reactivity profile, and application versatility ensures its continued importance across multiple scientific disciplines. As synthetic methodologies advance and new therapeutic approaches emerge, this compound will likely maintain its position as a key intermediate in innovative chemical solutions.
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