Lot numbers can be found on the outside label of a product:
(3,5-Dimethylisoxazol-4-yl)methanol
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CAS No. 19788-36-4
- Cat. No. CS-0085293
- Purity≥96%
- MDL No.MFCD00464226
*For research and further manufacturing use only, not for direct human use.
Structure of 19788-36-4
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General Information
- CAS No. 19788-36-4
- Cat. No. CS-0085293
- Purity ≥96%
- MDL No. MFCD00464226
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₆H₉NO₂
- Molecular Weight 127.14
- Synonym(s) 3,5-Dimethylisoxazole-4-methanol
- SMILES OCC1=C(C)ON=C1C
Description
This bench-stable, moisture-tolerant building block features a sterically hindered isoxazole ring fused to a primary alcohol group. The electron-rich heterocycle enables selective functionalization, while the hydroxyl moiety facilitates conjugation or derivatization in synthetic workflows.
Application
(3,5-Dimethylisoxazol-4-yl)methanol serves as a versatile heterocyclic building block in medicinal chemistry, enabling efficient access to isoxazole-containing scaffolds. Its hydroxymethyl functionality facilitates straightforward derivatization via etherification, oxidation, or coupling reactions. The molecule exhibits excellent bench stability and compatibility with standard synthetic protocols, making it well-suited for modular synthesis of bioactive compounds and API intermediates.
Synthesis
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Route1
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56328-87-1 - ~69%
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In-stock
19788-36-4
References
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TEMPERO PHARMACEUTICALS, INC.; BALOGLU, Erkan; GHOSH, Shomir; LOBERA, Mercedes; SCHMIDT, Darby, R. Patent: WO2013/19626 A1, 2013 ; Location in patent: Page/Page column 26 ; WO 2013/019626 A1
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Route2
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In-stock
2510-36-3 - ~69%
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In-stock
19788-36-4
References
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Natale, Nicholas R.; Quincy, David A. Synthetic Communications, 1983 , vol. 13, # 10 p. 817 - 822
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Route3
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In-stock
54593-26-9 - ~%
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In-stock
19788-36-4
References
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WO2010/132999 A1, ; Page/Page column 109 ;
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H315-H319-H335
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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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Quality Control
Computational Chemistry Data
- TPSA 46.26
- LogP 0.78374
- H_Acceptors 3
- H_Donors 1
- Rotatable_Bonds 1
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Key Words
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