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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

4(1H)-Quinazolinone, 7-bromo-

Brc1ccc2c(c1)nc[nH]c2=O Request for Quotation
Chemical Name: 4(1H)-Quinazolinone, 7-bromo-
CAS Number: 194851-16-6
Product Number: AG0034E3(AGN-PC-00VZ6O)
Synonyms:
MDL No:
Molecular Formula: C8H5BrN2O
Molecular Weight: 225.0421

Identification/Properties

Properties
MP:
259-260°C
BP:
428.7°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
225.045g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
223.959g/mol
Monoisotopic Mass:
223.959g/mol
Topological Polar Surface Area:
41.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
229
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-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


7-Bromoquinazolin-4(3H)-one is a versatile building block in chemical synthesis with applications across various industries. This compound is commonly used as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals. Its unique chemical structure allows for the modification of functional groups, enabling the development of diverse compounds with desired properties.In pharmaceutical synthesis, 7-Bromoquinazolin-4(3H)-one serves as a precursor in the production of bioactive molecules such as kinase inhibitors and anticancer agents. Its presence in the chemical structure of these compounds contributes to their pharmacological activity and therapeutic potential. Furthermore, its reactivity allows for the introduction of specific substituents to fine-tune the biological properties of the final product.In the agrochemical industry, this compound plays a crucial role in the creation of pesticides and herbicides. By incorporating 7-Bromoquinazolin-4(3H)-one into the molecular design of these agricultural chemicals, researchers can develop effective crop protection solutions that target specific pests and weeds while minimizing environmental impact.Additionally, 7-Bromoquinazolin-4(3H)-one is utilized in the synthesis of specialty chemicals with applications in materials science, organic electronics, and other innovative fields. Its ability to undergo various chemical reactions opens up possibilities for the creation of novel materials with tailored properties, such as advanced polymers, dyes, and molecular probes.Overall, the versatility and utility of 7-Bromoquinazolin-4(3H)-one make it a valuable asset in chemical synthesis, driving innovation and advancements in multiple industries. Its role as a foundational building block underscores its importance in the development of cutting-edge compounds with a wide range of practical applications.