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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)-

Benzene, 1-iodo-2-(trifluoromethoxy)-

Ic1ccccc1OC(F)(F)F Request for Quotation
Chemical Name: Benzene, 1-iodo-2-(trifluoromethoxy)-
CAS Number: 175278-00-9
Product Number: AG0020TV(AGN-PC-0KKY4P)
Synonyms:
MDL No:
Molecular Formula: C7H4F3IO
Molecular Weight: 288.0057

Identification/Properties

Properties
BP:
196.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Stability:
Light Sensitive
Refractive Index:
n20/D 1.5060(lit.)
Computed Properties
Molecular Weight:
288.008g/mol
XLogP3:
4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
287.926g/mol
Monoisotopic Mass:
287.926g/mol
Topological Polar Surface Area:
9.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
148
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


2-(Trifluoromethoxy)iodobenzene is a versatile chemical compound widely used in modern chemical synthesis. It serves as a valuable building block in organic reactions, particularly in the field of cross-coupling chemistry. The trifluoromethoxy group attached to the benzene ring imparts unique reactivity and properties to the molecule, making it a valuable tool in the creation of complex organic structures.In chemical synthesis, 2-(Trifluoromethoxy)iodobenzene is commonly employed as a reagent for introducing the trifluoromethoxy functional group into organic molecules. This transformation can lead to the enhancement of biological activity, as well as changes in the physical and chemical properties of the resulting compounds. Additionally, the iodo group can serve as a versatile handle for further functionalization, allowing for the creation of diverse molecular architectures.Moreover, 2-(Trifluoromethoxy)iodobenzene can participate in transition metal-catalyzed coupling reactions, such as palladium-catalyzed cross-coupling reactions. These reactions enable the formation of C-C, C-N, and C-O bonds, among others, leading to the construction of complex molecules with high efficiency. The presence of the trifluoromethoxy group can also influence the regioselectivity and stereoselectivity of these coupling reactions, offering a powerful tool for synthetic chemists to access a wide range of chemical space.Overall, the unique properties and reactivity of 2-(Trifluoromethoxy)iodobenzene make it a valuable reagent in chemical synthesis, opening up pathways to the creation of novel compounds with potential applications in pharmaceuticals, materials science, and agrochemicals.