2-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)methyl)pyridine

Base Information

• Chemical Name: 2-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)methyl)pyridine
• CAS No.: 864754-22-3
• Molecular Formula: C15H20 B N3 O2
• Molecular Weight: 285.154
• Hs Code.: 2934999090
• European Community (EC) Number: 801-801-5
• DSSTox Substance ID: DTXSID00592253
• Wikidata: Q82486265
• Mol file: 864754-22-3.mol

Synonyms:864754-22-3;2-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)methyl)pyridine;1-(Pyridin-2-ylmethyl)-1H-pyrazole-4-boronic acid, pinacol ester;2-[4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyrazol-1-ylmethyl]-pyridine;2-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]methyl]pyridine;2-{[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]methyl}pyridine;1-(2-Pyridinmethyl)pyrazole-4-boronic acid pinacol ester;SCHEMBL1356885;DTXSID00592253;MITHCPNYDGADHL-UHFFFAOYSA-N;[1-(2-Pyridylmethyl)pyrazol-4-yl]boronic acid pinacol ester;1-(Pyridin-2-ylmethyl)-1H-pyrazole-4-boronic acid pinacol ester;1-(2-PYRIDYLMETHYL)-1H-PYRAZOLE-4-BORONIC ACID PINACOL ESTER;MFCD08706030;AKOS015960296;SB12208;BS-25879;CS-0138702;Y10548;A863168;A1-06359;1-(pyridin-2-ylmethyl)-1H-pyrazole-4-boronic acid pinacol ester, AldrichCPR;2-[4-(4,4,5,5-tetramethyl-[1,3,2]-dioxaborolan-2-yl)pyrazol-1-ylmethyl]pyridine;2-{[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]methyl}pyridine

Chemical Property of 2-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)methyl)pyridine

Chemical Property:

• Vapor Pressure: 2.11E-07mmHg at 25°C
• Refractive Index: 1.559
• Boiling Point: 436.2°C at 760 mmHg
• Flash Point: 217.6°C
• PSA: 49.17000
• Density: 1.12g/cm³
• LogP: 1.62560
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 285.1648571
• Heavy Atom Count: 21
• Complexity: 362

Purity/Quality:

97% ^*data from raw suppliers

2-[4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyrazol-1-ylmethyl]-pyridine 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)CC3=CC=CC=N3

Technology Process of 2-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)methyl)pyridine

There total 4 articles about 2-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)methyl)pyridine 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: 85.0%

→ 2-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)methyl)pyridine (864754-22-3)

Guidance literature:

Reference yield: 51.7%

pyrazole-4-boronic acid pinacol ester (269410-08-4) + 2-(bromomethyl)pyridine hydrobromide (31106-82-8) → 2-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)methyl)pyridine (864754-22-3)

Guidance literature:

pyrazole-4-boronic acid pinacol ester; With sodium hydride; In N,N-dimethyl-formamide; mineral oil; at 20 ℃; for 0.5h;

2-(bromomethyl)pyridine hydrobromide; In N,N-dimethyl-formamide; mineral oil; at 20 ℃; for 20h;

Reference yield:

pyrazole-4-boronic acid pinacol ester (269410-08-4) + 2-(bromomethyl)pyridine hydrobromate → 2-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)methyl)pyridine (864754-22-3)

Guidance literature:

With potassium carbonate; In acetonitrile; at 80 ℃;

upstream raw materials:

pyrazole-4-boronic acid pinacol ester

2-chloromethylpyridine hydrochloride

2-(bromomethyl)pyridine hydrobromide

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