3-Fluoro-5-methoxyphenylboronic acid

Base Information

• Chemical Name: 3-Fluoro-5-methoxyphenylboronic acid
• CAS No.: 609807-25-2
• Molecular Formula: C7H8BFO3
• Molecular Weight: 169.948
• Hs Code.: 29163990
• European Community (EC) Number: 672-940-5
• DSSTox Substance ID: DTXSID80376836
• Wikidata: Q72474220
• Mol file: 609807-25-2.mol

Synonyms:3-Fluoro-5-methoxyphenylboronic acid;609807-25-2;(3-fluoro-5-methoxyphenyl)boronic acid;3-fluoro-5-methoxybenzeneboronic acid;MFCD07363780;(3-fluoro-5-methoxy-phenyl)boronic Acid;BORONIC ACID, (3-FLUORO-5-METHOXYPHENYL)-;3-Fluoro-5-methoxyphenylboronicacid;SCHEMBL447912;DTXSID80376836;MQFKLCWETPKBCH-UHFFFAOYSA-N;AMY29884;3-fluoro-5-methoxy phenylboronic acid;3-Fluoro-5-methoxyphenyl boronic acid;AKOS000285077;AB30754;CS-W000953;AS-14922;SY007591;A8477;F1063;FT-0649299;EN300-4254176;3-Fluoro-5-methoxyphenylboronic acid, AldrichCPR;J-512529;Z1201623979;3-Fluoro-5-methoxyphenylboronic Acid (contains varying amounts of Anhydride)

Chemical Property of 3-Fluoro-5-methoxyphenylboronic acid

Chemical Property:

• Vapor Pressure: 0.000357mmHg at 25°C
• Melting Point: 168-172 °C
• Refractive Index: 1.503
• Boiling Point: 305.5 °C at 760 mmHg
• PKA: 7.07±0.10(Predicted)
• Flash Point: 138.6 °C
• PSA: 49.69000
• Density: 1.26 g/cm³
• LogP: -0.48590
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 170.0550524
• Heavy Atom Count: 12
• Complexity: 145

Purity/Quality:

99% ^*data from raw suppliers

3-Fluoro-5-methoxyphenylboronicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xi,Xn
• Statements: 20/21/22-36/37/38-22
• Safety Statements: 26-36-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC(=CC(=C1)F)OC)(O)O
• Uses: suzuki reaction

Technology Process of 3-Fluoro-5-methoxyphenylboronic acid

There total 1 articles about 3-Fluoro-5-methoxyphenylboronic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

C9H12BFO3 → 3-fluoro-5-methoxyphenylboronic acid (609807-25-2)

Guidance literature:

With hydrogenchloride;

DOI:10.1016/S0960-894X(02)00460-2

Reference yield: 96.0%

tert-butyl N-[1-(3-bromo-5-formyl-4-pyridyl)-4-piperidyl]carbamate + 3-fluoro-5-methoxyphenylboronic acid (609807-25-2) → tert-butyl N-[1-[3-(3-fluoro-5-methoxyphenyl)-5-formyl-4-pyridyl]-4-piperidyl]carbamate

Guidance literature:

With potassium phosphate; bis(di-tert-?butyl(4-?dimethylaminophenyl)?phosphine)?dichloropalladium(II); In 1,4-dioxane; water; at 90 ℃; for 48h; Inert atmosphere;

DOI:10.1016/j.bmc.2021.116424

Reference yield: 95.0%

C25H32BrNO4 (1390665-75-4) + 3-fluoro-5-methoxyphenylboronic acid (609807-25-2) → C32H38FNO5 (1390666-18-8)

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; sodium carbonate; In N,N-dimethyl-formamide; at 60 ℃; for 8h; Inert atmosphere;

DOI:10.1016/j.bmcl.2012.05.124

Downstream raw materials:

4-(3-(3-fluoro-5-methoxyphenyl)-1H-pyrazol-4-yl)-2-(methylthio)pyrimidine

4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-2-trifluoromethylpent-4-enoic acid ethyl ester

2-(3-fluoro-4-methoxyphenyl)-5-(3-fluoro-5-methoxyphenyl)thiophene

2-(3-fluoro-5-methoxyphenyl)-5-(4-methoxyphenyl)thiophene

Refernces