(4-(Piperidin-1-yl)phenyl)boronic acid

Base Information

• Chemical Name: (4-(Piperidin-1-yl)phenyl)boronic acid
• CAS No.: 229009-42-1
• Molecular Formula: C₁₁H₁₆BNO₂
• Molecular Weight: 205.065
• Hs Code.: 2933399090
• Mol file: 229009-42-1.mol

Synonyms:(4-(Piperidin-1-yl)phenyl)boronic acid;4-(Piperidino)phenylboronic acid;Boronic acid, [4-(1-piperidinyl)phenyl]-;4-Piperidin-1-yl-phenylboronic acid;Boronic acid, B-[4-(1-piperidinyl)phenyl]-;4-(Piperidino)phenylboronicacid;SCHEMBL1745699;RVJPMWIIBKMWCR-UHFFFAOYSA-N;MFCD03095171;AKOS024438303;[4-(1-piperidinyl)phenyl]boronic acid;DS-18666;CS-0044979

Chemical Property of (4-(Piperidin-1-yl)phenyl)boronic acid

Chemical Property:

• PSA: 43.70000
• LogP: 1.22370
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 205.1274089
• Heavy Atom Count: 15
• Complexity: 187

Purity/Quality:

97% ^*data from raw suppliers

4-Piperidin-1-yl-phenylboronic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 41

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC=C(C=C1)N2CCCCC2)(O)O

Technology Process of (4-(Piperidin-1-yl)phenyl)boronic acid

There total 1 articles about (4-(Piperidin-1-yl)phenyl)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:

N-(4-bromophenyl)piperidine (22148-20-5) + 2-Isopropoxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (61676-62-8) → 4-(piperidin-1-yl)phenylboronic acid (229009-42-1)

Guidance literature:

N-(4-bromophenyl)piperidine; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 1h; Inert atmosphere;

2-Isopropoxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; In tetrahydrofuran; hexane; at 20 ℃; for 12h; Inert atmosphere;

DOI:10.5012/bkcs.2012.33.11.3629

Reference yield:

3-iodo-chromen-4-one (122775-34-2) + 4-(piperidin-1-yl)phenylboronic acid (229009-42-1) → C21H22N4O (1289141-72-5)

Guidance literature:

Multi-step reaction with 2 steps

1: palladium 10% on activated carbon; potassium carbonate / water; acetonitrile / 4 h / 50 - 60 °C

2: potassium carbonate / N,N-dimethyl-formamide / 6 h / 80 - 90 °C

With palladium 10% on activated carbon; potassium carbonate; In water; N,N-dimethyl-formamide; acetonitrile; 1: Suzuki coupling;

DOI:10.1021/jm101388d

upstream raw materials:

N-(4-bromophenyl)piperidine

2-Isopropoxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Downstream raw materials:

C₂₁H₂₂N₄O

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