4H-1,3-Benzoxazin-4-one, 2-(2-hydroxyphenyl)-


Chemical Name: 4H-1,3-Benzoxazin-4-one, 2-(2-hydroxyphenyl)-
CAS Number: 1218-69-5
Product Number: AG001622(AGN-PC-0O0CFT)
Synonyms:
MDL No:
Molecular Formula: C14H9NO3
Molecular Weight: 239.2262

Identification/Properties


Properties
MP:
204.0 to 208.0 °C
BP:
424.951°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
239.23g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
239.058g/mol
Monoisotopic Mass:
239.058g/mol
Topological Polar Surface Area:
58.9A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
366
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:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



The compound 2-(2-Hydroxyphenyl)-4H-benzo[e][1,3]oxazin-4-one, often referred to as $name$, is commonly utilized in chemical synthesis as a valuable intermediate in the production of various pharmaceuticals, agrochemicals, and organic materials. This versatile molecule serves as a key building block in the creation of complex structures due to its unique molecular architecture and reactivity.One of the primary applications of 2-(2-Hydroxyphenyl)-4H-benzo[e][1,3]oxazin-4-one in chemical synthesis is its role as a precursor in the synthesis of novel heterocyclic compounds. By utilizing its oxazinone moiety, chemists can introduce diversity and functionality into organic molecules through strategic functional group transformations and cyclization reactions. This enables the creation of diverse chemical libraries for drug discovery and other industrial applications.Furthermore, the hydroxyphenyl group present in the structure of 2-(2-Hydroxyphenyl)-4H-benzo[e][1,3]oxazin-4-one offers an excellent site for derivatization, allowing for the attachment of different functional groups or modifications to tailor the compound's properties for specific applications. This flexibility makes it a valuable building block for the synthesis of bioactive compounds, fluorescent dyes, and other specialized chemicals.Overall, the strategic placement of functional groups and the unique structural features of 2-(2-Hydroxyphenyl)-4H-benzo[e][1,3]oxazin-4-one make it a versatile and valuable tool in the hands of synthetic chemists, enabling the creation of diverse and complex molecules for a range of scientific and industrial purposes.