4-(4'-Chlorobenzyloxy)phenylboronic acid

Base Information

• Chemical Name: 4-(4'-Chlorobenzyloxy)phenylboronic acid
• CAS No.: 870778-91-9
• Molecular Formula: C13H12 B Cl O3
• Molecular Weight: 262.5
• Hs Code.: 2931900090
• European Community (EC) Number: 623-440-0
• DSSTox Substance ID: DTXSID00584633
• Wikidata: Q82476313
• Mol file: 870778-91-9.mol

Synonyms:870778-91-9;4-(4'-Chlorobenzyloxy)phenylboronic acid;(4-((4-Chlorobenzyl)oxy)phenyl)boronic acid;[4-[(4-chlorophenyl)methoxy]phenyl]boronic acid;{4-[(4-Chlorophenyl)methoxy]phenyl}boronic acid;4-(4-Chlorobenzyloxy)phenylboronic acid;SCHEMBL257888;DTXSID00584633;RONZDKNBNIRWIV-UHFFFAOYSA-N;VJB77891;MFCD07784349;AKOS009319994;BP-12126;BS-23168;4-(4''-Chlorobenzyloxy)phenylboronic Acid;(4-((4-Chlorobenzyl)oxy)phenyl)boronicacid;CS-0174602;EN300-222405;F76260;A862882;Z381513226

Chemical Property of 4-(4'-Chlorobenzyloxy)phenylboronic acid

Chemical Property:

• Vapor Pressure: 1.03E-08mmHg at 25°C
• Refractive Index: 1.605
• Boiling Point: 445.3°C at 760 mmHg
• Flash Point: 223.1°C
• PSA: 49.69000
• Density: 1.3g/cm³
• LogP: 1.59880
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 262.0568021
• Heavy Atom Count: 18
• Complexity: 236

Purity/Quality:

97% ^*data from raw suppliers

4-(4''-Chlorobenzyloxy)phenylboronicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC=C(C=C1)OCC2=CC=C(C=C2)Cl)(O)O
• Uses: 4-(4''-Chlorobenzyloxy)phenylboronic acid

Technology Process of 4-(4'-Chlorobenzyloxy)phenylboronic acid

There total 1 articles about 4-(4'-Chlorobenzyloxy)phenylboronic 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:

→ 4-(4’-chlorobenzyloxy)phenylboronic acid (870778-91-9)

Guidance literature:

Reference yield: 80.6%

4-(4’-chlorobenzyloxy)phenylboronic acid (870778-91-9) + (R)-tert-butyl 2-(4-bromo-N-(2-(tert-butoxycarbonylamino)ethyl)phenylsulfonamido)-3-methylbutanoate → (R)-tert-butyl 2-(N-(2-(tert-butoxycarbonylamino)ethyl)-4'-(4-chlorobenzyloxy)biphenyl-4-ylsulfonamido)-3-methylbutanoate

Guidance literature:

With potassium phosphate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 1,4-dioxane; water; at 70 ℃; for 2h; Inert atmosphere;

DOI:10.1002/cmdc.201600235

Reference yield: 75.0%

4-(4’-chlorobenzyloxy)phenylboronic acid (870778-91-9) + 3-bromo-5,8-dicarboxyquinoline → 3-[4-(4-chlorobenzyloxy)phenyl]quinoline-5,8-dicarboxylic acid

Guidance literature:

4-(4’-chlorobenzyloxy)phenylboronic acid; 3-bromo-5,8-dicarboxyquinoline; With tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 1,4-dioxane; at 20 ℃; for 0.5h;

With potassium carbonate; In 1,4-dioxane; water; for 18h; Inert atmosphere; Heating;

DOI:10.1002/cmdc.201800198

Downstream raw materials:

tert-butyl 2-(4'-(4-chlorobenzyloxy)-N-isopropoxybiphenyl-4-ylsulfonamido)acetate

tert-butyl (R)-2-(4'-(4-chlorobenzyloxy)-N-isopropoxybiphenyl-4-ylsulfonamido)-3-methylbutanoate