188677-49-8

Basic information

• Product Name: 3-IODOISONICOTINIC ACID METHYL ESTER
• Synonyms: Methyl 3-iodoisonicotinate;Methyl 3-iodopyridine-4-carboxylate;3-IODOISONICOTINIC ACID METHYL ESTER;3-IODOPYRIDINE-4-CARBOXYLIC ACID METHYL ESTER
• CAS NO: 188677-49-8
• Molecular Formula: C₇H₆INO₂
• Molecular Weight: 263.03
• Mol File: 188677-49-8.mol
• Article Data: 6

Chemical Properties

• Boiling Point: 278℃
• Flash Point: 122℃
• Appearance: /
• Density: 1.844
• Vapor Pressure: 0.00441mmHg at 25°C
• Refractive Index: 1.603
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• PKA: 1.09±0.18(Predicted)
• CAS DataBase Reference: 3-IODOISONICOTINIC ACID METHYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 3-IODOISONICOTINIC ACID METHYL ESTER(188677-49-8)
• EPA Substance Registry System: 3-IODOISONICOTINIC ACID METHYL ESTER(188677-49-8)

Safety Data

• Hazardous Substances Data: 188677-49-8(Hazardous Substances Data)

Usage

Description

3-IODOISONICOTINIC ACID METHYL ESTER is a chemical compound characterized by the molecular formula C7H6INO2. It is a derivative of isonicotinic acid, featuring a methyl ester group. 3-IODOISONICOTINIC ACID METHYL ESTER plays a significant role in organic synthesis, serving as a building block for the creation of more complex molecules. Its applications extend to the pharmaceutical industry, where it functions as an intermediate in the production of various drugs. Moreover, 3-iodoisonicotinic acid methyl ester has garnered attention in medicinal chemistry due to its potential biological and pharmacological activities.

Uses

Used in Organic Synthesis:
3-IODOISONICOTINIC ACID METHYL ESTER is used as a building block for the synthesis of more complex organic molecules. Its unique structure allows for the formation of a variety of compounds, making it a valuable component in the development of new chemical entities.
Used in Pharmaceutical Industry:
In the pharmaceutical industry, 3-IODOISONICOTINIC ACID METHYL ESTER is utilized as an intermediate in the production of various drugs. Its presence in the synthesis process contributes to the development of medications with diverse therapeutic applications.
Used in Medicinal Chemistry Research:
3-IODOISONICOTINIC ACID METHYL ESTER is used as a subject of interest in the field of medicinal chemistry. Its potential biological and pharmacological activities are being studied to explore its possible applications in the discovery and development of new therapeutic agents.

InChI:InChI=1/C7H6INO2/c1-11-7(10)5-2-3-9-4-6(5)8/h2-4H,1H3

Upstream product

• 57842-10-1 3-iodo-4-pyridinecarboxylic acid 
• 74-88-4 methyl iodide 
• 55279-30-6 methyl 3-aminoisonicotinate 
• 67-56-1 methanol 
• 57842-09-8 3-iodo-isonicotinanilide 
• 3034-31-9 N-phenylisonicotinamide 
• 7579-20-6 3-Aminopyridine-4-carboxylic acid 

Downstream Products

• 1192019-22-9 2-(3-ethylpyridin-4-yl)-5-(trifluoromethyl)benzoxazole 
• 1192019-19-4 2-(3-phenyl pyridin-4-yl)-5-(trifluoromethyl)benzoxazole 
• 1192021-11-6 N-[2-hydroxy-5-(trifluoromethyl)phenyl]-3-iodoisonicotinamide 
• 57842-10-1 3-iodo-4-pyridinecarboxylic acid 
• 1160262-11-2 methyl 3-(3,4-dichlorophenyl)pyridine-4-carboxylate monohydrochloride 
• 570397-03-4 4-(1-methoxycarbonyl-3-methylsulfanyl-propylcarbamoyl)-5-o-tolyl-3,6-dihydro-2H-pyridine-1-carboxylic acid 3-cyclohexyl-1-thiazol-5-yl-propyl ester 
• 355008-64-9 2-{[1-(benzyl-thiazol-5-ylmethyl-carbamoyl)-5-o-tolyl-1,2,3,6-tetrahydro-pyridine-4-carbonyl]-amino}-4-methylsulfanyl-butyric acid methyl ester 

Relevant articles and documents

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We herein describe the straightforward synthesis of a stable pyridyl(4-methoxyphenyl)iodonium salt and its [18F] radiolabeling within a one-step, fully automated and cGMP compliant radiosynthesis of [18F]UCB-H ([18F]7), a PET tracer for the imaging of synaptic vesicle glycoprotein 2A (SV2A). Over the course of 1 year, 50 automated productions provided 34 ± 2% of injectable [18F]7 from up to 285 GBq (7.7 Ci) of [18F]fluoride in 50 min (uncorrected radiochemical yield, specific activity of 815 ± 185 GBq/μmol). The successful implementation of our synthetic strategy within routine, high-activity, and cGMP productions attests to its practicality and reliability for the production of large doses of [18F]7. In addition to enabling efficient and cost-effective clinical research on a range of neurological pathologies through the imaging of SV2A, this work further demonstrates the real value of iodonium salts for the cGMP 18F-PET tracer manufacturing industry, and their ability to fulfill practical and regulatory requirements in that field.

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