149104-88-1

Basic information

• Product Name: 4-(METHYLSULFONYL)PHENYLBORONIC ACID
• Synonyms: (4-methanesulfonylphenyl)boranediol;4-(Methylsulfonyl)phenylboronic acid ,98%;4-[(Methylsulfonyl)phenylboronic acid , May contain varying amounts of anhydride, 97%;4-(Methanesulfonyl)phenylboronic acid,4-(Methylsulfonyl)phenylboronic acid;BP 14541 4-(METHANESULFONYL)PHENYLBORONIC ACID;4-Boronophenyl methyl sulphone;4-(Methanesulfonyl)phenylboronic Acid 4-(Methanesulfonyl)benzeneboronic Acid;Boronic acid, B-[4-(Methylsulfonyl)phenyl]-
• CAS NO: 149104-88-1
• Molecular Formula: C₇H₉BO₄S
• Molecular Weight: 200.02
• EINECS: 1592732-453-0
• Product Categories: B (Classes of Boron Compounds);Boronic Acids & Esters;Phenyls & Phenyl-Het;Boronate Ester;Potassium Trifluoroborate;blocks;BoronicAcids;Boronic Acids & Esters;Phenyls & Phenyl-Het;Boronic acids;Boronic Acid;Aryl;Organoborons;Sulfonyl
• Mol File: 149104-88-1.mol
• Article Data: 3

Chemical Properties

• Melting Point: 275-277 °C
• Boiling Point: 445.5 °C at 760 mmHg
• Flash Point: 223.2 °C
• Appearance: Off-white/Powder
• Density: 1.39 g/cm³
• Vapor Pressure: 1.02E-08mmHg at 25°C
• Refractive Index: 1.566
• Storage Temp.: 0-6°C
• Solubility: soluble in Methanol
• PKA: 7.22±0.10(Predicted)
• CAS DataBase Reference: 4-(METHYLSULFONYL)PHENYLBORONIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 4-(METHYLSULFONYL)PHENYLBORONIC ACID(149104-88-1)
• EPA Substance Registry System: 4-(METHYLSULFONYL)PHENYLBORONIC ACID(149104-88-1)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 37/39-26-24/25-22
• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 149104-88-1(Hazardous Substances Data)

Usage

Chemical Properties

Off-white powder

Uses

Different sources of media describe the Uses of 149104-88-1 differently. You can refer to the following data:
1. suzuki reaction
2. 4-(Methylsulfonyl)phenylboronic Acid is a heteroaryl boronic acid that was tested for their in vitro hormone-sensitive lipase inhibitory properties.
3. 4-(Methanesulfonyl)phenylboronic acid may be used as reagent for:sequential Suzuki cross-coupling reactions Copper-catalyzed oxidative trifluoromethylthiolation of aryl boronic acids directed metalation and regioselective functionalization of 3-bromofuran and related heterocycles Barton-Zard pyrrole cyclocondensations and Baeyer-Villiger oxidations diplar cycloaddition and palladium-catalyzed cross-coupling processescontinuous flow Suzuki reactions for odanacatib intermediate synthesisReagent used in Preparation ofdiarylaminopyridines as potential anti-malarial agents hydropyranopyrazine via chloropyrazinecarboxaldehyde and olefination biaryl sulfone derivatives as antagonists of the histamine H3 receptor novel kinase inhibitor scaffolds with potential antitumor effects Hepatitis C virus inhibition activity of N-hydroxyisoquinoline di

General Description

Contains varying amounts of anhydride

InChI:InChI=1/C7H9BO4S/c1-13(11,12)7-4-2-6(3-5-7)8(9)10/h2-5,9-10H,1H3

Upstream product

• 98546-51-1 (4-thiomethoxyphenyl)boronic acid 
• 850693-09-3 C₇H₇BF₃O₂S^(1-) 

Downstream Products

• 68528-29-0 5-(4-methanesulfonylphenyl)furan-2-carbaldehyde 
• 267235-57-4 2-(3-fluoro-phenyl)-3-(4-methanesulfonyl-phenyl)-6-trifluoromethyl-pyrazolo[1,5-a]pyridine 
• 891273-56-6 6-(4-fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1,3-dimethyl-1H-pyrazolo[4,3-c]pyridine 
• 291743-85-6 2-(4-fluorophenyl)-3-[4-(methylsulfonyl)phenyl]pyrazolo[1,5-a]pyridine-6-carbonitrile 
• 876616-93-2 2-[2-(4'-methanesulfonyl-biphenyl-4-yl)-5-methyl-oxazol-4-yl]-ethanol 
• 876618-59-6 3-[2-(4'-methanesulfonyl-biphenyl-4-yl)-5-methyl-oxazol-4-yl]-propan-1-ol 
• 876618-68-7 1-[2-(4'-methanesulfonyl-biphenyl-4-yl)-5-methyl-oxazol-4-yl]-2-(2R-methyl-pyrrolidin-1-yl)-ethanol 
• 412914-10-4 2-Acetylamino-5-(4-methanesulfonyl-phenyl)-thiophene-3-carboxylic acid amide 
• 1132094-73-5 1-[(4-methoxybenzyl)amino]-7-[4-(methylsulfonyl)phenyl][1]benzothieno[3,2-c]pyridine-4-carbonitrile 
• 945724-16-3 7-[4-(methylsulfonyl)phenyl]-3-pyrrolidin-1-ylchroman-4-ol 
• 1064622-78-1 (3R,6S,8R)-6-(2-fluoro-2-methylpropyl)-8-[4'-(methylsulfonyl)biphenyl-4-yl]-5-oxo-8-(trifluoromethyl)-1-thia-4,7-diazacycloundec-9-yne-3-carbonitrile 
• 1005201-25-1 2-methyl-5-{3-[4-(methylsulfonyl)phenyl]-1-benzofuran-5-yl}-1,3,4-oxadiazole 
• 1232411-11-8 5-(4-(methylsulfonyl)phenyl)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine 
• 1159488-60-4 (S)-4-fluoro-4-methyl-2-[(S)-2,2,2-trifluoro-1-(4'-methanesulfonyl-biphenyl-4-yl)-ethylamino]-pentanoic acid ((S)-benzyl-cyano-methyl)-amide 

Relevant articles and documents

COMPOSITES, METHODS AND USES THEREOF

The present invention relates, in general terms, to methods of catalysing a reaction, including the steps of contacting a chemical entity comprising a sulphide moiety with a composite and an oxidant. The composite acts as a heterogeneous catalyst to oxidise the sulphide moiety. The present invention also relates to composites, methods of synthesising the composites and its use as a catalyst thereof.

Substituent effects on aryltrifluoroborate solvolysis in water: Implications for Suzuki-Miyaura coupling and the design of stable 18F-labeled aryltrifluoroborates for use in PET imaging

(Chemical Equation Presented) Whereas electron withdrawing substituents retard the rate of aryltrifluoroborate solvolysis, electron-donating groups enhance it. Herein is presented a Hammett analysis of the solvolytic lability of aryltrifluoroborates where log(Ksolv) values correlate to a values with a ρ value of approximately -1. This work provides a predictable rubric for tuning the reactivity of boron for several uses including 18F-labeled PET reagents and has mechanistic implications for ArBF3-enhanced ligandless metal-mediated cross coupling reactions with aryltrifluoroborates.