4-Isoxazolemethanol, 5-methyl-3-phenyl-


Chemical Name: 4-Isoxazolemethanol, 5-methyl-3-phenyl-
CAS Number: 18718-79-1
Product Number: AG007S1J(AGN-PC-0KKXBL)
Synonyms:
MDL No:
Molecular Formula: C11H11NO2
Molecular Weight: 189.2105

Identification/Properties


Computed Properties
Molecular Weight:
189.214g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
189.079g/mol
Monoisotopic Mass:
189.079g/mol
Topological Polar Surface Area:
46.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
180
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



The compound 5-Methyl-3-phenylisoxazol-4-yl)methanol, also known as $name$, serves as a versatile building block in chemical synthesis. With its unique structural properties, $name$ is utilized in the formation of complex organic molecules through various chemical reactions.One key application of $name$ in chemical synthesis is as a starting material in the preparation of heterocyclic compounds. Its isoxazole ring structure, combined with the phenyl and methyl groups, provides an opportunity for diverse functionalization through substitution or addition reactions. This enables the creation of novel compounds with potential pharmaceutical, agricultural, or materials science applications.Furthermore, the hydroxyl group in $name$ can undergo various transformations, such as esterification or etherification, leading to the synthesis of a wide range of derivatives. These derivatives can exhibit altered chemical and physical properties compared to the parent compound, opening up possibilities for tailored applications in different fields of chemistry.In summary, the strategic incorporation of 5-Methyl-3-phenylisoxazol-4-yl)methanol in chemical synthesis offers a pathway to accessing structurally diverse compounds with unique properties and potential utility in various scientific and industrial endeavors.