876189-18-3

Basic information

• Product Name: 5-Methoxycarbonyl-2-methylphenylboronic acid
• Synonyms: 5-Methoxycarbonyl-2-methylphenylboronic acid;Methyl 3-borono-4-methylbenzoate
• CAS NO: 876189-18-3
• Molecular Formula: C₉H₁₁BO₄
• Molecular Weight: 193.99224
• Mol File: 876189-18-3.mol

Chemical Properties

• Boiling Point: 375.353 °C at 760 mmHg
• Flash Point: 180.807 °C
• Appearance: /
• Density: 1.219 g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.528
• Storage Temp.: Room temperature.
• PKA: 7.81±0.58(Predicted)
• CAS DataBase Reference: 5-Methoxycarbonyl-2-methylphenylboronic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 5-Methoxycarbonyl-2-methylphenylboronic acid(876189-18-3)
• EPA Substance Registry System: 5-Methoxycarbonyl-2-methylphenylboronic acid(876189-18-3)

Safety Data

• Hazardous Substances Data: 876189-18-3(Hazardous Substances Data)

Usage

Uses

Used in Organic Synthesis:
5-Methoxycarbonyl-2-methylphenylboronic acid is used as a reagent in organic synthesis for its ability to form stable covalent complexes with diols and other Lewis bases, facilitating the synthesis of complex organic molecules.
Used in Medicinal Chemistry:
In the field of medicinal chemistry, 5-Methoxycarbonyl-2-methylphenylboronic acid is used as a building block for the development of new drug candidates, leveraging its ability to form reversible covalent bonds with biological targets.
Used in Suzuki-Miyaura Cross-Coupling Reactions:
5-Methoxycarbonyl-2-methylphenylboronic acid is utilized as a key component in Suzuki-Miyaura cross-coupling reactions, which are crucial for the synthesis of complex organic molecules and have significant applications in the production of pharmaceuticals and agrochemicals.
Used in Sensor Development:
5-Methoxycarbonyl-2-methylphenylboronic acid is employed as a sensing element in the development of sensors, capitalizing on its ability to form stable complexes with various Lewis bases, thereby enhancing the sensitivity and selectivity of the sensors.
Used in Catalyst Design:
5-Methoxycarbonyl-2-methylphenylboronic acid is used as a catalyst or a catalyst precursor in various chemical reactions, taking advantage of its Lewis acidic properties to improve reaction efficiency and selectivity.
Overall, 5-Methoxycarbonyl-2-methylphenylboronic acid has diverse and promising applications across the fields of chemistry and pharmaceuticals, making it an important compound for researchers and industry professionals alike.

InChI:InChI=1/C9H11BO4/c1-6-3-4-7(9(11)14-2)5-8(6)10(12)13/h3-5,12-13H,1-2H3

Upstream product

• 67-56-1 methanol 
• 170230-88-3 3-carboxy-6-methylphenylboronic acid 
• 7664-93-9 sulfuric acid 
• 882679-40-5 methyl 4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate 
• 104901-43-1 methyl 3-bromo-4-methylbenzoate 
• 90347-66-3 methyl 3-iodo-4-methylbenzoate 
• 7697-26-9 3-bromo-4-methylbenzoic acid 

Downstream Products

• 1221343-13-0 methyl 3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-4-methylbenzoate 
• 1070293-31-0 N-cyclopropyl-4-methyl-3-{1-oxo-2-[3-(2-pyrrolidin-1-ylethoxy)benzyl]-1,2-dihydroisoquinolin-6-yl}benzamide 
• 1070292-67-9 4-{4-[6-(5-methoxycarbonyl-2-methylphenyl)-1-oxo-1H-isoquinolin-2-ylmethyl]phenyl}-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester 
• 1070292-89-5 N-cyclopropyl-3-(2-(4-((2-(dimethylamino)ethyl)(methyl)carbamoyl)benzyl)-1-oxo-1,2-dihydroisoquinolin-6-yl)-4-methylbenzamide 
• 1070293-08-1 N-cyclopropyl-4-methyl-3-(1-oxo-2-(4-(pyrrolidin-1-ylmethyl)benzyl)-1,2-dihydroisoquinolin-6-yl)benzamide 
• 1070295-83-8 4-[6-(5-cyclopropylcarbamoyl-2-methylphenyl)-1-oxo-1H-isoquinolin-2-ylmethyl]piperidine-1-carboxylic acid tert-butyl ester 
• 1070294-40-4 3-(2-benzyl-1-oxo-4-(pyrrolidin-1-ylmethyl)-1,2-dihydroisoquinolin-6-yl)-N-cyclopropyl-4-methylbenzamide 
• 1070293-16-1 N-cyclopropyl-3-(2-((6-(3-(dimethylamino)propoxy)pyridin-3-yl)methyl)-1-oxo-1,2-dihydroisoquinolin-6-yl)-4-methylbenzamide 
• 1070295-25-8 3-(2-benzyl-4-(3-(dimethylamino)propyl)-1-oxo-1,2-dihydroisoquinolin-6-yl)-N-cyclopropyl-4-methylbenzamide 
• 1070292-71-5 N-methoxy-4-methyl-3-[1-oxo-2-[4-(1,2,3,6-tetrahydropyridin-4-yl)benzyl]-1,2-dihydroisoquinolin-6-yl]benzamide 
• 1070293-25-2 N-cyclopropyl-3-(2-(4-(2-(dimethylamino)ethoxy)benzyl)-1-oxo-1,2-dihydroisoquinolin-6-yl)-4-methylbenzamide 
• 1070292-94-2 4-((6-(5-(cyclopropylcarbamoyl)-2-methylphenyl)-1-oxoisoquinolin-2(1H)-yl)methyl)benzoic acid 
• 1070293-29-6 3-(2-(4-(2-chloroethoxy)benzyl)-1-oxo-1,2-dihydroisoquinolin-6-yl)-N-cyclopropyl-4-methylbenzamide 
• 1070292-63-5 4-methyl-3-{2-[4-(4-methylpiperazin-1-yl)benzyl]-1-oxo-1,2-dihydroisoquinolin-6-yl}benzoic acid methyl ester 

Relevant articles and documents

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