Production Method 1

330558-48-0

954240-10-9

Reaction Conditions

1.1 Reagents: Sodium borohydride Solvents: Methanol ,  Tetrahydrofuran ;  30 min, rt

Reference

Discovery of a Novel Potent and Selective HSD17B13 Inhibitor, BI-3231, a Well-Characterized Chemical Probe Available for Open Science

Thamm, Sven ; Willwacher, Marina K. ; Aspnes, Gary E.; Bretschneider, Tom; Brown, Nicholas F.; et al, Journal of Medicinal Chemistry, 2023, 66(4), 2832-2850

Production Method 2

912347-83-2

954240-10-9

Reaction Conditions

1.1 Reagents: Lithium aluminum hydride Solvents: Tetrahydrofuran ;  0 °C; 1 h, rt
1.2 Reagents: Ammonium chloride Solvents: Water ;  rt

Reference

Synthesis and antimicrobial evaluation of benzothiazole linked isoxazole Schiff bases

Mallikarjun, G.; Raju, A. Krishnam; Yadav, J. S., Indian Journal of Chemistry, 2021, (11), 1463-1470

Production Method 3

591-31-1

954240-10-9

Reaction Conditions

1.1 Reagents: Hydroxyamine hydrochloride Catalysts: Sodium carbonate ;  25 °C
1.2 Reagents: Chlorosuccinimide Catalysts: Triethylamine ;  0 °C → reflux

Reference

Nicotinic acid derivative useful in treatment of cancer and its preparation

, China, , ,

Production Method 4

954240-10-9

Reaction Conditions

Reference

Preparation of quinoline derivatives and their application as anticancer agents

, China, , ,

(3-(3-Methoxyphenyl)isoxazol-5-yl)methanol Raw materials

• 5-Isoxazolecarboxylic acid, 3-(3-methoxyphenyl)-, ethyl ester
• methyl 3-(3-methoxyphenyl)isoxazole-5-carboxylate
• 3-Methoxybenzaldehyde

(3-(3-Methoxyphenyl)isoxazol-5-yl)methanol Preparation Products

• (3-(3-Methoxyphenyl)isoxazol-5-yl)methanol (954240-10-9)

• 1. Examination of the hydrogen-bonding networks in small water clusters (n = 2–5, 13, 17) using absolutely localized molecular orbital energy decomposition analysis?
  Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
• 2. Distinct impact of glycation towards the aggregation and toxicity of murine and human amyloid-β?
  Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
• 3. Evolution of calcium phosphate precipitation in hanging drop vapor diffusion by in situRaman microspectroscopy
  Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
• 4. Excitation dependent bidirectional electron transfer in phthalocyanine-functionalised MoS2 nanosheets?
  Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
• 5. Emerging investigator series: heterogeneous reactions of sulfur dioxide on mineral dust nanoparticles: from single component to mixed components?
  Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833

Comprehensive Overview of (3-(3-Methoxyphenyl)isoxazol-5-yl)methanol (CAS No. 954240-10-9)

(3-(3-Methoxyphenyl)isoxazol-5-yl)methanol, with the CAS number 954240-10-9, is a specialized organic compound that has garnered significant attention in pharmaceutical and agrochemical research. This compound belongs to the isoxazole family, known for its versatile applications in drug discovery and material science. The presence of a methoxyphenyl group and a hydroxymethyl functionality makes it a valuable intermediate for synthesizing more complex molecules. Researchers are particularly interested in its potential as a building block for bioactive compounds, given its structural uniqueness and reactivity.

In recent years, the demand for isoxazole derivatives like (3-(3-Methoxyphenyl)isoxazol-5-yl)methanol has surged due to their role in developing novel therapeutics. The compound's CAS No. 954240-10-9 is frequently searched in academic and industrial databases, reflecting its relevance in medicinal chemistry. Its methanol moiety allows for further functionalization, enabling the creation of derivatives with enhanced pharmacological properties. This adaptability aligns with current trends in precision medicine and targeted drug delivery, where customized molecular structures are critical.

The synthesis of (3-(3-Methoxyphenyl)isoxazol-5-yl)methanol involves multi-step organic reactions, often starting from 3-methoxybenzaldehyde or related precursors. Its isoxazole ring is synthesized via cyclization reactions, a topic of interest in green chemistry due to the growing emphasis on sustainable synthetic methods. Researchers are exploring catalyst-free and solvent-free approaches to optimize the production process, addressing environmental concerns while maintaining high yields.

Beyond pharmaceuticals, CAS No. 954240-10-9 is also investigated for its potential in agrochemical formulations. The methoxyphenyl group contributes to its lipophilicity, which can enhance the bioavailability of pesticide or herbicide formulations. This dual applicability in human health and crop protection underscores its industrial significance. Additionally, its stability under various conditions makes it a candidate for material science applications, such as polymer additives or fluorescent probes.

Analytical characterization of (3-(3-Methoxyphenyl)isoxazol-5-yl)methanol typically involves techniques like NMR spectroscopy, mass spectrometry, and HPLC. These methods confirm its purity and structural integrity, which are crucial for quality control in commercial production. The compound's spectral data is often shared in open-access databases, facilitating collaboration among researchers worldwide. This transparency supports the open science movement, a hot topic in modern research ecosystems.

In summary, (3-(3-Methoxyphenyl)isoxazol-5-yl)methanol (CAS No. 954240-10-9) is a multifaceted compound with broad applications in drug development, agriculture, and material innovation. Its unique structure and functional groups make it a subject of ongoing research, particularly in the context of sustainable chemistry and personalized medicine. As scientific inquiries into isoxazole chemistry expand, this compound is poised to remain a key player in advancing molecular design and industrial applications.

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