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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)-

2(1H)-Pyrimidinone, 4-methyl-6-(trifluoromethyl)-

FC(c1cc(C)nc(=O)[nH]1)(F)F Request for Quotation
Chemical Name: 2(1H)-Pyrimidinone, 4-methyl-6-(trifluoromethyl)-
CAS Number: 91606-60-9
Product Number: AG006FSM(AGN-PC-0OMRX6)
Synonyms:
MDL No:
Molecular Formula: C6H5F3N2O
Molecular Weight: 178.1119

Identification/Properties

Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
178.114g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
178.035g/mol
Monoisotopic Mass:
178.035g/mol
Topological Polar Surface Area:
41.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
277
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-Methyl-6-(trifluoromethyl)pyrimidin-2(1H)-one is a versatile compound frequently utilized in chemical synthesis. Its unique structure and reactivity make it a valuable building block in the development of pharmaceuticals, agrochemicals, and materials science.In chemical synthesis, this compound can be employed as a key intermediate for the preparation of various heterocyclic compounds. Its trifluoromethyl group confers distinct properties, enhancing the biological activity and physical properties of the final products. By functionalizing the pyrimidine core, chemists can access a wide array of derivatives with tailored traits.Furthermore, the 4-Methyl-6-(trifluoromethyl)pyrimidin-2(1H)-one moiety can participate in diverse synthetic transformations, such as nucleophilic substitutions, metal-catalyzed reactions, and cyclization processes. These reactions enable the construction of complex molecular structures with high efficiency and selectivity.Overall, the strategic incorporation of 4-Methyl-6-(trifluoromethyl)pyrimidin-2(1H)-one in chemical synthesis facilitates the generation of sophisticated compounds with valuable properties, showcasing its significance in modern organic chemistry.