4-(2-Ethoxy-2-oxoethoxy)benzeneboronic acid

Base Information

• Chemical Name: 4-(2-Ethoxy-2-oxoethoxy)benzeneboronic acid
• CAS No.: 282116-97-6
• Molecular Formula: C10H13BO5
• Molecular Weight: 224.021
• Hs Code.: 2931900090
• European Community (EC) Number: 801-540-7
• DSSTox Substance ID: DTXSID10591616
• Wikidata: Q82485421
• Mol file: 282116-97-6.mol

Synonyms:282116-97-6;4-(2-Ethoxy-2-oxoethoxy)benzeneboronic acid;(4-(2-Ethoxy-2-oxoethoxy)phenyl)boronic acid;4-(2-Ethoxy-2-oxoethoxy)phenylboronic acid;[4-(2-ethoxy-2-oxoethoxy)phenyl]boronic acid;4-(2-ETHOXY-2-OXOETHOXY)BENZENEBORONIC ACID 98;C10H13BO5;(4-(2-Ethoxy-2-oxoethoxy)phenyl)boronicacid;SCHEMBL2749470;DTXSID10591616;MECJJOCHJYCOJS-UHFFFAOYSA-N;MFCD08235079;AKOS015838704;AC-24827;AS-55350;CS-0174554;4-(2-ethoxy-2-oxoethoxy)-benzeneboronic acid;[4-(2-ethoxy-2-oxo-ethoxy)phenyl]boronic acid;A819376

Chemical Property of 4-(2-Ethoxy-2-oxoethoxy)benzeneboronic acid

Chemical Property:

• Vapor Pressure: 1.48E-06mmHg at 25°C
• Melting Point: 145-147 °C
• Refractive Index: 1.52
• Boiling Point: 383.2 °C at 760 mmHg
• PKA: 8.62±0.16(Predicted)
• Flash Point: 185.5 °C
• PSA: 75.99000
• Density: 1.22 g/cm³
• LogP: -0.69170
• Storage Temp.: Keep Cold
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 224.0856037
• Heavy Atom Count: 16
• Complexity: 213

Purity/Quality:

99% ^*data from raw suppliers

4-(2-Ethoxy-2-oxoethoxy)phenylboronicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-(2-Ethoxy-2-oxoethoxy)benzeneboronic acid

There total 1 articles about 4-(2-Ethoxy-2-oxoethoxy)benzeneboronic 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-(Ethoxycarbonylmethoxy)phenyl)boronic acid (282116-97-6)

Guidance literature:

Reference yield: 93.0%

(4-(Ethoxycarbonylmethoxy)phenyl)boronic acid (282116-97-6) + (R)-(+)-2-(1-hydroxyethyl)-6-bromopyridine (138983-04-7) → C15H15NO4

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; potassium carbonate; In 1,2-dimethoxyethane; water; at 100 ℃; for 0.5h; Microwave irradiation;

Reference yield: 54.0%

benzoimidazole (51-17-2,79351-71-6) + (4-(Ethoxycarbonylmethoxy)phenyl)boronic acid (282116-97-6) → ethyl [4-(1H-benzimidazol-1-yl)phenoxy]acetate (1345687-66-2)

Guidance literature:

With pyridine; copper diacetate; In dichloromethane; at 20 ℃; Molecular sieve;

Downstream raw materials:

{4-[3-((R)-1-naphthalen-1-yl-ethylamino)-cyclopentyl]-phenoxy}-acetic acid ethyl ester

{4-[3-((R)-1-naphthalen-1-yl-ethylamino)-cyclopentyl]-phenoxy}-acetic acid ethyl ester

{4-[(1R,3S)-3-{[(1R)-1-(Naphthalen-1-yl)ethyl]amino}cyclopentyl]phenoxy}acetic acid ethyl ester

{4-[3-((R)-1-naphthalen-1-yl-ethylamino)-cyclopentyl]-phenoxy}-acetic acid ethyl ester

Refernces