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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)-

ethyl 2-bromo-5-iodobenzoate

CCOC(=O)c1cc(I)ccc1Br Request for Quotation
Chemical Name: ethyl 2-bromo-5-iodobenzoate
CAS Number: 1208075-44-8
Product Number: AG003Q3L(AGN-PC-08XZAD)
Synonyms:
MDL No:
Molecular Formula: C9H8BrIO2
Molecular Weight: 354.9671

Identification/Properties

Properties
BP:
341.8±27.0°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
354.969g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
353.875g/mol
Monoisotopic Mass:
353.875g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
187
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


Ethyl 2-bromo-5-iodobenzoate is a valuable building block in organic synthesis, particularly in the field of medicinal chemistry. Its unique structure makes it a versatile intermediate in the production of pharmaceutical compounds, agrochemicals, and advanced materials. This compound is often employed as a key starting material for the synthesis of complex molecules due to its ability to undergo various functional group transformations. Its strategic positioning of both bromine and iodine atoms allows for selective substitution reactions, leading to the generation of diverse chemical entities with tailored properties. In chemical synthesis, Ethyl 2-bromo-5-iodobenzoate serves as a crucial scaffold for the construction of biologically active molecules and functional materials through controlled derivatization and further elaboration. Its broad synthetic utility and compatibility with various reaction conditions make it an indispensable component of modern organic chemistry research.