103594-69-0

Basic information

• Product Name: 2(1H)-Pyrimidinone, 5-iodo-1-(phenylmethyl)-
• CAS NO: 103594-69-0
• Molecular Formula: C11H9IN2O
• Molecular Weight: 312.11
• Mol File: 103594-69-0.mol
• Article Data: 3

Chemical Properties

• CAS DataBase Reference: 2(1H)-Pyrimidinone, 5-iodo-1-(phenylmethyl)-(CAS DataBase Reference)
• NIST Chemistry Reference: 2(1H)-Pyrimidinone, 5-iodo-1-(phenylmethyl)-(103594-69-0)
• EPA Substance Registry System: 2(1H)-Pyrimidinone, 5-iodo-1-(phenylmethyl)-(103594-69-0)

Safety Data

• Hazardous Substances Data: 103594-69-0(Hazardous Substances Data)

Usage

Molecular structure

Contains a pyrimidine ring, with an iodine atom and a phenylmethyl group attached.

Classification

Heterocyclic compound

Usage

Commonly used in the pharmaceutical industry as a building block for the synthesis of various pharmaceutical drugs and organic compounds.

Reactivity

Unique reactivity and versatility in organic synthesis due to the presence of an iodine atom and a phenylmethyl group.

Applications

Widespread in the preparation of antiviral, antibacterial, and antifungal drugs, as well as in the development of new materials and pharmaceutical intermediates.

Importance

A valuable chemical in organic chemistry research and drug discovery due to its versatility and broad applicability.

Upstream product

• 100-39-0 benzyl bromide 
• 79387-69-2 5-iodo-2(1H)-pyrimidinone 

Downstream Products

• 1315330-33-6 1-benzyl-5-(trimethylsilylethynyl)pyrimidin-2-(1H)-one 
• 1315330-40-5 C₁₄H₁₄N₂O₂ 
• 1315330-28-9 1-benzyl-5-ethynylpyrimidin-2(1H)-one 
• 103594-81-6 1-benzyl-5-iodo-4-phenylpyrimidin-2(1H)-one 
• 107377-19-5 1-benzyl-3,4-dihydro-5-iodopyrimidin-2(1H)-one 
• 103594-73-6 1-benzyl-3,4-dihydro-5-iodo-4-phenylpyrimidin-2(1H)-one 
• 122476-83-9 1-benzyl-5-β-styryl-2(1H)-pyrimidinone 

Relevant articles and documents

Evaluation of α-pyrones and pyrimidones as photoaffinity probes for affinity-based protein profiling

α-Pyrones and pyrimidones are common structural motifs in natural products and bioactive compounds. They also display photochemistry that generates high-energy intermediates that may be capable of protein reactivity. A library of pyrones and pyrimidones was synthesized, and their potential to act as photoaffinity probes for nondirected affinity-based protein profiling in several crude cell lysates was evaluated. Further "proof-of-principle" experiments demonstrate that a pyrimidone tag on an appropriate scaffold is equally capable of proteome labeling as a benzophenone.

Structure Investigations on Products from the Reaction of Organocopper, Organolithium and Organomagnesium Reagents with 2(1H)-Pyrimidinones

Alkyl- and arylcuprates and alkyl- and aryllithium and -magnesium reagents form 3,4- or/and 3,6-adducts with 1-benzyl-2(1H)pyrimidinones.The effect of 5-halo substituents on the reactivity and regioselectivity is reported.Structure analyses were made by NMR spectroscopy.Dehydrogenation gives the conjugated, substituted pyrimidinines.X-Ray crystallographic data for 1-benzyl-5-chloro-4-phenyl-2(1H)-pyrimidinone and its regioisomer 1-benzyl-5-chloro-6-phenyl-2(1H)-pyrimidinone are discussed.