6-Ethoxy-2-naphthaleneboronic acid

Base Information

• Chemical Name: 6-Ethoxy-2-naphthaleneboronic acid
• CAS No.: 352525-98-5
• Molecular Formula: C12H13BO3
• Molecular Weight: 216.044
• Hs Code.: 29319090
• European Community (EC) Number: 623-788-3
• DSSTox Substance ID: DTXSID90405141
• Nikkaji Number: J2.172.315K
• Wikidata: Q72471834
• Mol file: 352525-98-5.mol

Synonyms:352525-98-5;6-Ethoxy-2-naphthaleneboronic acid;(6-ethoxynaphthalen-2-yl)boronic Acid;6-ETHOXYNAPHTHALENE-2-BORONIC ACID;BORONIC ACID, (6-ETHOXY-2-NAPHTHALENYL)-;MFCD03427009;6-Ethoxy-2-naphthylboronic acid;6-ethoxynaphthalen-2-ylboronic acid;SCHEMBL8514;DTXSID90405141;INXXVGFSXYJGHI-UHFFFAOYSA-N;?6-Ethoxy-2-naphthaleneboronic acid;AKOS004114103;AB15027;CS-W000235;CS-W014868;AS-15073;SY047753;E1107;FT-0644490;A822679;J-518678;6-Ethoxy-2-naphthaleneboronic acid(contains varying amounts of Anhydride)

Chemical Property of 6-Ethoxy-2-naphthaleneboronic acid

Chemical Property:

• Melting Point: 252-255 °C(lit.)
• Boiling Point: 423.2 °C at 760 mmHg
• PKA: 8.74±0.30(Predicted)
• Flash Point: 209.8 °C
• PSA: 49.69000
• Density: 1.2 g/cm³
• LogP: 0.91830
• Storage Temp.: Keep Cold
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 216.0957744
• Heavy Atom Count: 16
• Complexity: 222

Purity/Quality:

99% ^*data from raw suppliers

6-Ethoxy-2-naphthaleneboronic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC2=C(C=C1)C=C(C=C2)OCC)(O)O
• Uses: suzuki reaction

Technology Process of 6-Ethoxy-2-naphthaleneboronic acid

There total 1 articles about 6-Ethoxy-2-naphthaleneboronic 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:

→ (6-ethoxynaphthalen-2-yl)boronic acid (352525-98-5)

Guidance literature:

Reference yield: 87.0%

(6-ethoxynaphthalen-2-yl)boronic acid (352525-98-5) + 4-[2-(perfluorohexyl)ethylsulfanyl]bromobenzene (1322744-72-8) → 2-ethoxy-6-[4-(2-perfluorohexyl)ethylsulfanyl]phenylnaphthalene

Guidance literature:

With palladium diacetate; tris-(o-tolyl)phosphine; In 1,4-dioxane; for 12h; Inert atmosphere; Reflux;

DOI:10.1080/15421406.2017.1289617

Reference yield: 81.0%

(6-ethoxynaphthalen-2-yl)boronic acid (352525-98-5) + 3-bromo-1-(3,4-dimethoxy-benzyl)maleimide (909397-79-1) → C25H23NO5 (923982-51-8)

Guidance literature:

With cesium fluoride; (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; In 1,4-dioxane; at 20 - 40 ℃; for 3h;

Downstream raw materials:

2-acetamide-1,3-bisacetoxy-2-(2-(3-(6-ethoxynaphthalen-2-yl)phenyl)ethyl)propane

C₂₅H₂₃NO₅

Refernces