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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)-

Dimethyl 5-amino-2,4,6-triiodo-1,3-benzenedicarboxylate

COC(=O)c1c(I)c(C(=O)OC)c(c(c1I)N)I Request for Quotation
Chemical Name: Dimethyl 5-amino-2,4,6-triiodo-1,3-benzenedicarboxylate
CAS Number: 154921-11-6
Product Number: AG001NHP(AGN-PC-0N3CQ7)
Synonyms:
MDL No:
Molecular Formula: C10H8I3NO4
Molecular Weight: 586.8882

Identification/Properties

Properties
BP:
500.4±50.0 °C(Predicted)
Storage:
Room Temperature;Light sensitive;
Computed Properties
Molecular Weight:
586.89g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
586.759g/mol
Monoisotopic Mass:
586.759g/mol
Topological Polar Surface Area:
78.6A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
311
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


Dimethyl 5-amino-2,4,6-triiodoisophthalate is a versatile compound widely utilized in chemical synthesis due to its unique properties and reactivity. This compound serves as a valuable building block in the preparation of various organic compounds, especially in the field of medicinal chemistry. In chemical synthesis, Dimethyl 5-amino-2,4,6-triiodoisophthalate can be employed as a key intermediate for the synthesis of complex molecules and pharmaceuticals. Its triiodo-substituted structure imparts significant reactivity, making it a useful reagent for introducing iodine-containing functional groups into target molecules. Additionally, the amino group offers the potential for further chemical modifications, enabling the creation of diverse molecular structures.Furthermore, this compound plays a crucial role in the development of contrast agents for medical imaging applications, such as in radiology and nuclear medicine. The triiodo-substituted moiety is particularly advantageous for enhancing the visibility of specific tissues or organs in diagnostic imaging procedures, contributing to the advancement of healthcare technology.Overall, Dimethyl 5-amino-2,4,6-triiodoisophthalate demonstrates exceptional versatility and utility in chemical synthesis, enabling the efficient and targeted synthesis of various compounds with applications across different industries.