2-Methyl-6-methoxypyridine-3-boronic acid

Base Information

• Chemical Name: 2-Methyl-6-methoxypyridine-3-boronic acid
• CAS No.: 459856-12-3
• Molecular Formula: C7H10 B N O3
• Molecular Weight: 166.972
• Hs Code.: 2933399090
• European Community (EC) Number: 691-343-0
• DSSTox Substance ID: DTXSID70376724
• Wikidata: Q82165629
• Mol file: 459856-12-3.mol

Synonyms:459856-12-3;2-METHYL-6-METHOXYPYRIDINE-3-BORONIC ACID;(6-methoxy-2-methylpyridin-3-yl)boronic acid;6-METHOXY-2-METHYLPYRIDINE-3-BORONIC ACID;6-Methoxy-2-methylpyridin-3-ylboronic acid;6-Methoxy-2-picoline-3-boronic acid;MFCD05662386;BORONIC ACID, (6-METHOXY-2-METHYL-3-PYRIDINYL)-;2-Methyl-6-methoxy-pyridine-3-boronic acid;(6-methoxy-2-methyl-pyridin-3-yl)boronic Acid;SCHEMBL248283;DTXSID70376724;CWXWIICBKIHZFC-UHFFFAOYSA-N;AMY15127;AKOS006295187;AB21731;2-methoxy-6-methyl-5-pyridylboronic acid;6-methoxy-2-methylpyridin-3-boronic acid;CS-16010;SY029535;(6-methoxy-2-methylpyridin-3-yl)boronicacid;6-methoxy-2-methyl-pyridin-3-ylboronic acid;CS-0084055;FT-0647854;(6-methoxy-2-methyl-3-pyridinyl)boronic acid;F52079;EN300-6957484;6-METHOXY-2-METHYL-3-PYRIDINEBORONIC ACID;A826949;(6-METHOXY-2-METHYL-3-PYRIDYL)BORONIC ACID;J-510022;2-Methyl-6-methoxypyridine-3-boronic acid, AldrichCPR

Chemical Property of 2-Methyl-6-methoxypyridine-3-boronic acid

Chemical Property:

• Vapor Pressure: 0.000146mmHg at 25°C
• Boiling Point: 318.9°Cat760mmHg
• Flash Point: 146.7°C
• PSA: 62.58000
• Density: 1.2g/cm³
• LogP: -0.92160
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 167.0753733
• Heavy Atom Count: 12
• Complexity: 145

Purity/Quality:

98%min ^*data from raw suppliers

2-Methyl-6-methoxy-pyridine-3-boronic acid 95% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 37/38-41
• Safety Statements: 26-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=C(N=C(C=C1)OC)C)(O)O

Technology Process of 2-Methyl-6-methoxypyridine-3-boronic acid

There total 3 articles about 2-Methyl-6-methoxypyridine-3-boronic 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:

3-bromo-6-methoxy-2-methylpyridine (126717-59-7) → (6-methoxy-2-methylpyridin-3-yl)boronic acid (459856-12-3)

Guidance literature:

3-bromo-6-methoxy-2-methylpyridine; With n-butyllithium; In tetrahydrofuran; hexane; at -70 ℃; for 1h; Cooling with acetone-dry ice;

With Triisopropyl borate; In tetrahydrofuran; hexane; at -70 - 20 ℃; for 16.6667h; Cooling with acetone-dry ice;

With acetic acid; In tetrahydrofuran; hexane; at 20 ℃; for 1h;

Reference yield:

Triisopropyl borate (5419-55-6) + 3-bromo-6-methoxy-2-methylpyridine (126717-59-7) → (6-methoxy-2-methylpyridin-3-yl)boronic acid (459856-12-3)

Guidance literature:

With n-butyllithium; acetic acid; In tetrahydrofuran; hexane; water; isopropyl alcohol;

Reference yield:

C13H22BNO3 → (6-methoxy-2-methylpyridin-3-yl)boronic acid (459856-12-3)

Guidance literature:

With water; acetic acid; In tetrahydrofuran; hexane; for 2h; Inert atmosphere;

DOI:10.1021/jm900025h

upstream raw materials:

3-bromo-6-methoxy-2-methylpyridine

Triisopropyl borate

Downstream raw materials:

2'-benzyloxy-6-methoxy-2-methyl-3'-nitro-[3,4']bipyridinyl

4-(2-(6-methoxy-2-methylpyridin-3-yl)-1-(trifluoromethylsulfonyl)-1-1H-indol-5-yl)-3-methylbenzonitrile

C₂₄H₃₀N₂O₄

Refernces

• 1、 Gilligan, Paul J.,Clarke, Todd,He, Liqi,Lelas, Snjezana,Li, Yu-Wen,Heman, Karen,Fitzgerald, Lawrence,Miller, Keith,Zhang, Ge,Marshall, Anne,Krause, Carol,McElroy, John F.,Ward, Kathyrn,Zeller, Kim,Wong, Harvey,Bai, Steven,Saye, Joanne,Grossman, Scott,Zaczek, Robert,Arneric, Stephen P.,Hartig, Paul,Robertson, David,Trainor, George. "Synthesis and structure-activity relationships of 8-(pyrid-3-yl)pyrazolo[1, 5-a]-1,3,5-triazines: Potent, orally bioavailable corticotropin releasing factor receptor-1 (CRF1) antagonists". experimental part. p. 3084 - 3092. Retrieved 2010/02/28.
• 2、 -. "4 - (2-butylamino) - 2, 7-dimethyl-8- (2-methyl-6-methoxypyrid-3-yl) pyrazolo- [1,5-A] - 1,3,5-triazine, its enantiomers and pharmaceutically acceptable salts as corticotropin releasing factor receptor ligands". . . Retrieved 2008/06/13.