103440-52-4

Basic information

• Product Name: Methyl 2-iodo-5-methylbenzoate
• Synonyms: Methyl 2-iodo-5-Methylbenzoate;Methyl 2-iodo-5-methylbenzoate;2-Iodo-5-methylbenzoic acid methyl ester;Benzoic acid, 2-iodo-5-methyl-, methyl ester
• CAS NO: 103440-52-4
• Molecular Formula: C₉H₉IO₂
• Molecular Weight: 276.08
• Product Categories: Acids & Esters;Iodine Compounds
• Mol File: 103440-52-4.mol
• Article Data: 20

Chemical Properties

• Boiling Point: 105°C/0.6mmHg(lit.)
• Flash Point: >110℃
• Appearance: /
• Density: 1.674 g/mL at 25 °C
• Vapor Pressure: 0.004mmHg at 25°C
• Refractive Index: n20/D1.596
• Storage Temp.: 2-8°C
• Sensitive: Light Sensitive
• CAS DataBase Reference: Methyl 2-iodo-5-methylbenzoate(CAS DataBase Reference)
• NIST Chemistry Reference: Methyl 2-iodo-5-methylbenzoate(103440-52-4)
• EPA Substance Registry System: Methyl 2-iodo-5-methylbenzoate(103440-52-4)

Safety Data

• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 103440-52-4(Hazardous Substances Data)

Usage

General Description

Methyl 2-iodo-5-methylbenzoate is a chemical compound with the molecular formula C9H9IO2. It is a methyl ester of 2-iodo-5-methylbenzoic acid and is commonly used in organic synthesis and pharmaceutical research. Methyl 2-iodo-5-methylbenzoate is a white to off-white crystalline solid that is insoluble in water but soluble in organic solvents. Methyl 2-iodo-5-methylbenzoate is often used as an intermediate in the production of various pharmaceuticals and agrochemicals. It is also utilized in the preparation of a wide range of organic compounds through esterification and other chemical reactions. Additionally, it has potential applications in the development of new materials and chemical processes.

InChI:InChI=1/C9H9IO2/c1-6-3-4-8(10)7(5-6)9(11)12-2/h3-5H,1-2H3

Upstream product

• 67-56-1 methanol 
• 52548-14-8 2-iodoyl-5-methylbenzoic acid 
• 1445-45-0 Trimethyl orthoacetate 
• 74-88-4 methyl iodide 
• 99-04-7 m-Toluic acid 
• 18595-16-9 2-amino-5-methylbenzoic acid methyl ester 
• 2941-78-8 2-Amino-5-methylbenzoic acid 

Downstream Products

• 54811-39-1 5-Methyl-2-(2-naphthyl)-benzoesaeure-methylester 
• 930785-21-0 2-butoxy-9-(4-iodo-3-methoxycarbonylbenzyl)-8-methoxyadenine 
• 1088994-18-6 5-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid methyl ester 
• 1369842-36-3 methyl 2-[(diethoxyphosphoryl)difluoromethyl]-5-methylbenzoate 
• 1262397-73-8 5-methyl-2-(pyridin-2-yl)benzoic acid 
• 1262659-62-0 5-methyl-2-(pyridin-2-yl)benzoic acid methyl ester 
• 1088994-22-2 5-methyl-2-(pyrimidin-2-yl)benzoic acid 
• 1088994-20-0 5-methyl-2-(pyrimidin-2-yl)benzoic acid methyl ester 
• 1417741-79-7 2-[(2-ethynyl-4,5-dimethoxyphenyl)ethynyl]-5-methylbenzoic acid 
• 1418035-95-6 C₂₁H₁₈O₄ 
• 1360789-44-1 methyl 5-methyl-2-((E)-4-hydroxybut-1-enyl)benzoate 
• 1360789-85-0 C₁₉H₃₀O₃Si 
• 1364301-72-3 C₁₁H₁₁ClO₂ 
• 1364301-61-0 C₁₂H₁₃ClO₂ 

Relevant articles and documents

Mechanochemical-Cascaded C-N Cross-Coupling and Halogenation Using N-Bromo- And N-Chlorosuccinimide as Bifunctional Reagents

Exploration of alternative energy sources for chemical transformations has gained significant interest from chemists, and mechanochemistry is one of those sources. Herein, we report the use of N-bromosuccinimides (NBS) and N-chlorosuccinimides (NCS) as bifunctional reagents for a cascaded C-N bond formation and subsequent halogenation reactions. Under the solvent-free mechanochemical (ball-milling) conditions, the synthesis of a wide range of phenanthridinone derivatives from N-methoxy-[1,1′-biphenyl]-2-carboxamides is accomplished. During the reactions, NBS and NCS first assisted the oxidative C-N coupling reaction and subsequently promoted a halogenation reaction. Thus, the role of NBS and NCS was established to be bifunctional. Overall, a mild, solvent-free, convenient, one-pot, and direct synthesis of various bromo- and chloro-substituted phenanthridinone derivatives was achieved.

Method for preparing iodo-benzoic acid (ester) by improving moral Michael reaction

The invention discloses a method for preparing iodo-benzoic acid (ester) by improving a moral reaction, and belongs to the technical field of organic synthesis. The method comprises the following steps: preparing and separating the diazonium tetrafluoroborate through diazotization of aminobenzoic acid (ester) and then performing iodination reaction with the iodinated reagent in an organic medium to obtain the corresponding iodo carboxylic acid (ester). The iodo-benzoic acid (ester) prepared by the method has high purity. The method has the advantages of good quality and simple post-treatment, and the product yield reaches 70 - 90%.

QUINAZOLINE-2,4-DIONE DERIVATIVES AS PARP INHIBITORS

The present invention relates to compounds of formula (I) and compositions containing said compounds acting as PARP (Poly (ADP- ribose) polymerase) inhibitors. Moreover, the present invention provides processes for the preparation of the disclosed compounds, as well as methods of using them, for instance as a medicine, in particular for the treatment of cell proliferative disorders, such as cancer.