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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)-

Benzoic acid, 2-chloro-4-iodo-

Ic1ccc(c(c1)Cl)C(=O)O Request for Quotation
Chemical Name: Benzoic acid, 2-chloro-4-iodo-
CAS Number: 145343-76-6
Product Number: AG001KTU(AGN-PC-0JWK74)
Synonyms:
MDL No:
Molecular Formula: C7H4ClIO2
Molecular Weight: 282.4629

Identification/Properties

Properties
MP:
166-170 °C
BP:
337.9 °C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
282.461g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
281.894g/mol
Monoisotopic Mass:
281.894g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
163
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


2-Chloro-4-iodobenzoic acid is a versatile compound frequently employed in chemical synthesis due to its unique reactivity and structural properties. In organic synthesis, 2-Chloro-4-iodobenzoic acid serves as a valuable building block for the preparation of various organic molecules and pharmaceutical compounds. Its halogen substituents enable selective transformations through cross-coupling reactions, allowing for the introduction of desired functional groups at specific positions in a target molecule. Furthermore, the presence of both chlorine and iodine atoms in the molecular structure provides opportunities for diverse chemical modifications, such as halogen exchange reactions or nucleophilic substitutions. These reactions can be utilized to access a range of intermediates or final products with tailored physicochemical properties for specific applications. Overall, the strategic incorporation of 2-Chloro-4-iodobenzoic acid in chemical synthesis enables synthetic chemists to access a wide array of complex molecules efficiently and offers significant flexibility in designing synthetic routes for various medicinal, agrochemical, or material science applications.