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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)-

1-[3-(trifluoromethoxy)phenyl]piperazin-2-one

O=C1CNCCN1c1cccc(c1)OC(F)(F)F.Cl Request for Quotation
Chemical Name: 1-[3-(trifluoromethoxy)phenyl]piperazin-2-one
CAS Number: 215649-79-9
Product Number: AG007PX8(AGN-PC-00P4KJ)
Synonyms:
MDL No:
Molecular Formula: C11H12ClF3N2O2
Molecular Weight: 296.6734

Identification/Properties

Computed Properties
Molecular Weight:
296.674g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
296.054g/mol
Monoisotopic Mass:
296.054g/mol
Topological Polar Surface Area:
41.6A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
309
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:
2
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


1-(3-(Trifluoromethoxy)phenyl)piperazin-2-one is a versatile compound that finds wide utility in chemical synthesis. Its unique structure, featuring a trifluoromethoxy group and a piperazin-2-one moiety, makes it a valuable building block for the construction of diverse molecules in both academic research and industrial applications.One key application of 1-(3-(Trifluoromethoxy)phenyl)piperazin-2-one is in medicinal chemistry, where it serves as a valuable intermediate for the synthesis of bioactive compounds. The trifluoromethoxy group imparts desirable physicochemical properties and can enhance the biological activity of the final products. By leveraging the reactivity of the piperazin-2-one ring, chemists can introduce various functional groups to tailor the properties of the target molecules for specific biological targets.Furthermore, this compound is utilized in the preparation of fluorinated building blocks for agrochemicals, materials science, and pharmaceuticals. The trifluoromethoxy substituent can improve the metabolic stability and lipophilicity of the final products, making them more effective and selective in their respective applications. In organic synthesis, 1-(3-(Trifluoromethoxy)phenyl)piperazin-2-one can participate in a range of transformations, including nucleophilic substitutions, cycloadditions, and cross-coupling reactions, enabling the construction of complex molecular scaffolds with high efficiency.Overall, the versatility and reactivity of 1-(3-(Trifluoromethoxy)phenyl)piperazin-2-one make it a valuable tool for chemists seeking to access novel compounds with enhanced properties for a variety of applications in drug discovery, materials science, and agrochemistry.