31786-45-5

Basic information

• Product Name: 2-BROMO-6-METHOXYBENZOIC ACID
• Synonyms: 2-BROMO-6-METHOXYBENZOIC ACID;6-Bromo-o-anisic acid
• CAS NO: 31786-45-5
• Molecular Formula: C₈H₇BrO₃
• Molecular Weight: 231.04338
• Mol File: 31786-45-5.mol
• Article Data: 9

Chemical Properties

• Melting Point: 127-129 °C
• Boiling Point: 315.119 °C at 760 mmHg
• Flash Point: 144.379 °C
• Appearance: /
• Density: 1.625 g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.584
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility: Chloroform (Sparingly), Methanol (Slightly)
• PKA: 2.74±0.10(Predicted)
• CAS DataBase Reference: 2-BROMO-6-METHOXYBENZOIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 2-BROMO-6-METHOXYBENZOIC ACID(31786-45-5)
• EPA Substance Registry System: 2-BROMO-6-METHOXYBENZOIC ACID(31786-45-5)

Safety Data

• HazardClass: IRRITANT
• Hazardous Substances Data: 31786-45-5(Hazardous Substances Data)

Usage

General Description

2-Bromo-6-methoxybenzoic acid is a chemical compound with the molecular formula C8H7BrO3. It is a derivative of benzoic acid and contains a bromine atom and a methoxy group attached to the benzoic acid core. 2-BROMO-6-METHOXYBENZOIC ACID is used in organic synthesis and in the pharmaceutical industry as a building block in the production of various drugs and pharmaceutical compounds. It is also used in the production of agrochemicals and dyes. Additionally, it has been studied for its potential biological activities, including anti-inflammatory and anticancer properties.

InChI:InChI=1/C8H7BrO3/c1-12-6-4-2-3-5(9)7(6)8(10)11/h2-4H,1H3,(H,10,11)

Upstream product

• 126712-07-0 2-bromo-6-methoxybenzaldehyde 
• 579-75-9 2-Methoxybenzoic acid 
• 124-38-9 carbon dioxide 
• 95970-22-2 1,2-dibromo-3-methoxybenzene 
• 811711-33-8 1,2-dibromo-3-fluorobenzene 
• 53600-33-2 6-methoxyanthranilic acid 
• 154351-20-9 ethyl 2-(N-ethoxycarbonyl-N-pivaloyl)amino-6-methoxybenzoate 
• 146463-87-8 ethyl 2-(N-ethoxycarbonyl-N-pivaloyl)amino-6-(tetrahydropyran-2-yloxy)benzoate 
• 360575-28-6 2-bromo-6-fluorobenzaldehyde 
• 1073-06-9 3-fluorobromobenzene 

Downstream Products

• 126955-75-7 1-(2-carboxy-3-methoxy)phenyl-3-methyl-6-nitro-1H-indazole 
• 93710-52-2 (2-bromo-6-methoxyphenyl)methanol 
• 93710-57-7 (2-bromo-6-methoxyphenyl)acetic acid 
• 93710-53-3 2-bromo-6-methoxybenzylchloride 
• 93710-55-5 2-(2-bromo-6-methoxyphenyl)acetonitrile 
• 93710-63-5 N-(3-hydroxy-4-methoxyphenethyl)-2-(2-bromo-6-methoxyphenyl)acetamide 
• 93710-62-4 N-(3-benzyloxy-4-methoxyphenethyl)-2-(2-bromo-6-methoxyphenyl)acetamide 
• 791559-34-7 2-(6-Bromo-3-methyl-indazol-1-yl)-6-methoxy-benzoic acid 
• 142854-09-9 6-amino-1-(2-carboxy-3-methoxyphenyl)-3-methylindazole 
• 1307741-16-7 N-butyl-2-bromo-N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-6-methoxybenzamide 
• 1261645-01-5 2-bromo-6-methoxybenzoyl chloride 
• 1431546-82-5 ((2-bromo-6-methoxybenzyl)oxy)(tert-butyl)dimethyl silane 
• 1431546-83-6 (E)-ethyl 3-(2-(((tert-butyldimethylsilyl)oxy)methyl)-3-methoxyphenyl)acrylate 
• 1431546-84-7 (E)-3-(2-(((tert-butyldimethylsilyl)oxy)methyl)-3-methoxyphenyl)acrylic acid 

Relevant articles and documents

Dihydroisocoumarin derivative and preparation method and application thereof

The present invention discloses a dihydroisocoumarin derivative and preparation method and application thereof, the dihydroisocoumarin derivative having a structure as shown in formula (I) or (II). The method of preparing dihydroisocoumarin derivatives of

Zn-Catalyzed Enantio- and Diastereoselective Formal [4 + 2] Cycloaddition Involving Two Electron-Deficient Partners: Asymmetric Synthesis of Piperidines from 1-Azadienes and Nitro-Alkenes

We report a catalytic asymmetric synthesis of piperidines through [4 + 2] cycloaddition of 1-azadienes and nitro-alkenes. The reaction uses earth abundant Zn as catalyst and is highly diastereo- and regioselective. A novel BOPA ligand (F-BOPA) confers high reactivity and enantioselectivity in the process. The presence of ortho substitution on the arenes adjacent to the bis(oxazolines) was found to be particularly impactful, due to limiting the undesired coordination of 1-azadiene to the Lewis acid and thus allowing the reaction to be carried out at lower temperature. A series of secondary kinetic isotope effect studies using a range of ligands implicates a stepwise mechanism for the transformation, involving an initial Michael-type addition of the imine to the nitro-alkene followed by a cyclization event. The stepwise mechanism obviates the electronic requirement inherent to a concerted mechanism, explaining the successful cycloaddition between two electron-deficient partners. (Chemical Equation Presented).

Regioselective halogen-metal exchange reaction of 3-substituted 1,2-dibromo arenes: The synthesis of 2-substituted 5-bromobenzoic acids

Regioselective halogen-metal exchange reactions using isopropylmagnesium chloride were carried out on 3-substituted 1,2-dibromo arenes. Eleven examples are given. Georg Thieme Verlag Stuttgart.