ChemicalBook--->CAS DataBase List--->395082-55-0

395082-55-0

395082-55-0 Structure

395082-55-0 Structure
IdentificationBack Directory
[Name]

2-chloro-4-iodopyrimidine
[CAS]

395082-55-0
[Synonyms]

2-chloro-4-iodopyrimidine
Pyrimidine, 2-chloro-4-iodo-
[Molecular Formula]

C4H2ClIN2
[MOL File]

395082-55-0.mol
[Molecular Weight]

240.43
Chemical PropertiesBack Directory
[Melting point ]

111.3-112.4 °C
[Boiling point ]

317.8±15.0 °C(Predicted)
[density ]

2.187±0.06 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[pka]

-2.88±0.20(Predicted)
[InChI]

InChI=1S/C4H2ClIN2/c5-4-7-2-1-3(6)8-4/h1-2H
[InChIKey]

LOPQDJJEZFCJMU-UHFFFAOYSA-N
[SMILES]

C1(Cl)=NC=CC(I)=N1
Hazard InformationBack Directory
[Description]

2-Chloro-4-iodopyrimidine is an inhibitor of protein kinases. It binds to the ATP site of a kinase and inhibits its activity by forming a covalent bond with the serine or threonine residue of the active site. 2-Chloro-4-iodopyrimidine has been shown to inhibit tumor cell proliferation and induce apoptosis in vitro and in vivo. This compound has been shown to inhibit the activity of family kinases, including those involved in tumor growth and angiogenesis.
[Preparation]

The raw material and cuprous iodide are homogeneously mixed in acetonitrile. Add tert-butyl nitroso ester at -2 °C and stir for 5 min to heat the reaction to 73 °C. After 3h of the reaction, the raw material reaction was completed by TLC detection, cooled to room temperature, and water and saturated sodium carbonate solution were added to the reaction. Finally, the product is purified to obtain the product
2-chloro-4-iodopyrimidine
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