2,4(1H,3H)-Quinazolinedione, 5-fluoro-


Chemical Name: 2,4(1H,3H)-Quinazolinedione, 5-fluoro-
CAS Number: 192570-33-5
Product Number: AG003MRT(AGN-PC-0JU8IN)
Synonyms:
MDL No: MFCD09954841
Molecular Formula: C8H5FN2O2
Molecular Weight: 180.1359

Identification/Properties


Properties
MP:
320-322℃ (ethanol )
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
180.138g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
180.034g/mol
Monoisotopic Mass:
180.034g/mol
Topological Polar Surface Area:
58.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
257
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



5-Fluoroquinazoline-2,4(1H,3H)-dione is a versatile compound that finds application in chemical synthesis as a key building block for the creation of a variety of pharmaceuticals and organic compounds. Due to its unique structure and reactivity, this compound serves as a valuable starting material in the preparation of complex molecules through various synthetic routes.One important use of 5-Fluoroquinazoline-2,4(1H,3H)-dione lies in its ability to undergo substitution reactions at the fluorine atom, allowing for the introduction of different functional groups at this position. This feature enables chemists to tailor the properties of the final compound for specific applications, such as in drug discovery and development.Furthermore, the presence of the quinazoline ring system in this compound provides a scaffold that is commonly found in bioactive molecules. By incorporating 5-Fluoroquinazoline-2,4(1H,3H)-dione into the synthesis of target compounds, researchers can take advantage of this structural motif to enhance the biological activity or pharmacokinetic profile of the final products.In summary, 5-Fluoroquinazoline-2,4(1H,3H)-dione plays a crucial role in chemical synthesis by serving as a valuable intermediate for the creation of diverse compounds with potential applications in drug discovery and other fields of organic chemistry.