(2-((Diethylamino)methyl)phenyl)boronic acid

Base Information

• Chemical Name: (2-((Diethylamino)methyl)phenyl)boronic acid
• CAS No.: 95753-24-5
• Molecular Formula: C11H18BNO2
• Molecular Weight: 207.08
• DSSTox Substance ID: DTXSID50538186
• Nikkaji Number: J2.619.914J
• Wikidata: Q82413433
• Mol file: 95753-24-5.mol

Synonyms:95753-24-5;(2-((Diethylamino)methyl)phenyl)boronic acid;2-((DIETHYLAMINO)METHYL)PHENYLBORONIC ACID;2-[(Diethylamino)methyl]phenylboronic acid;[2-(Diethylaminomethyl)phenyl]boronic acid;{2-[(Diethylamino)methyl]phenyl}boronic acid;Boronic acid, [2-[(diethylamino)methyl]phenyl]-;(2-((Diethylamino)methyl)phenyl)boronicacid;SCHEMBL1133300;DTXSID50538186;MFCD06801713;AKOS004113878;AB30146;AM87499;BS-24555;CS-0176010;I12263;A858821;2-[(Diethylamino)methyl]phenylboronic acid, AldrichCPR

Chemical Property of (2-((Diethylamino)methyl)phenyl)boronic acid

Chemical Property:

• PSA: 43.70000
• LogP: 0.20820
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 207.1430590
• Heavy Atom Count: 15
• Complexity: 174

Purity/Quality:

97% ^*data from raw suppliers

2-((Diethylamino)methyl)phenylboronicacid ^*data from reagent suppliers

Safty Information:

• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC=CC=C1CN(CC)CC)(O)O
• Uses: 2-((Diethylamino)methyl)phenylboronic acid

Technology Process of (2-((Diethylamino)methyl)phenyl)boronic acid

There total 1 articles about (2-((Diethylamino)methyl)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: 67.0%

2,4,6-Tris[o-(bromomethyl)phenyl]boroxine (7481-16-5) + diethylamine (109-89-7) → 2-[(diethylamino)methyl]phenyl boronic acid (95753-24-5)

Guidance literature:

In toluene; stirring of the boroxine with diethylamine in toluene at room temp. for15 h; heating at 70°C for 1 h;; filtration; evapn. of the filtrate; drying under vac.; elem. anal.;;

Reference yield: 84.0%

(S)-1,2-Propanediol (4254-15-3,63625-56-9) + 2-[(diethylamino)methyl]phenyl boronic acid (95753-24-5) → 2-(2-[(diethylamino)methyl]phenyl)-(4S)-4-methyl-1,3,2-dioxaborolane

Guidance literature:

In toluene; byproducts: H2O; heating equimolar amts. of the boronic acid and (S)-1,2-propanediol in toluene;; concn.; distn.; elem. anal.;;

Reference yield: 79.0%

2,2-Dimethyl-1,3-propanediol (126-30-7) + 2-[(diethylamino)methyl]phenyl boronic acid (95753-24-5) → 2-(2-[(diethylamino)methyl]phenyl)-5,5-dimethyl-1,3,2-dioxaborinane (95753-13-2)

Guidance literature:

In toluene; byproducts: H2O; heating equimolar amts. of the boronic acid and 2,2-dimethyl-1,3-propanediol in toluene;; concn.; distn.; elem. anal.;;

upstream raw materials:

2,4,6-Tris[o-(bromomethyl)phenyl]boroxine

diethylamine

Downstream raw materials:

2-(2-[(diethylamino)methyl]phenyl)-5,5-dimethyl-1,3,2-dioxaborinane

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