2-(2-Phenoxyethoxy)ethanol

Base Information

• Chemical Name: 2-(2-Phenoxyethoxy)ethanol
• CAS No.: 104-68-7
• Molecular Formula: C10H14 O3
• Molecular Weight: 182.219
• Hs Code.: 2909499000
• European Community (EC) Number: 203-227-5
• NSC Number: 406593
• UNII: LZU6ET206Z
• DSSTox Substance ID: DTXSID0051528
• Nikkaji Number: J22.146E
• Wikidata: Q27283278
• Mol file: 104-68-7.mol

Synonyms:2-(2-Phenoxyethoxy)ethanol;104-68-7;Diethylene glycol monophenyl ether;Phenyl carbitol;ETHANOL, 2-(2-PHENOXYETHOXY)-;Phenoxydiglycol;Diethylene glycol phenyl ether;Fenylkarbitol;Diethylene glycolphenyl ether;2-(2-phenoxyethoxy)ethan-1-ol;Fenylkarbitol [Czech];EINECS 203-227-5;UNII-LZU6ET206Z;NSC 406593;BRN 2093125;LZU6ET206Z;AI3-04321;diethyleneglycol monophenyl ether;NSC-406593;EC 203-227-5;Ethanol,2-(2-phenoxyethoxy)-;phenyl diglycol;O(CCOCCO)c1ccccc1;PHENYL DI GLYCOL;WLN: Q2O2OR;SCHEMBL24035;DTXSID0051528;MFCD00045989;NSC406593;AKOS008145660;ther de dithylneglycol et de monophnyle;AS-41733;LS-67009;CS-0217586;D5139;FT-0696890;EN300-78435;W-109056;Q27283278;Z756092452

Chemical Property of 2-(2-Phenoxyethoxy)ethanol

Chemical Property:

• Vapor Pressure: 0.000277mmHg at 25°C
• Melting Point: -49.9°C
• Refractive Index: 1.5230 to 1.5270
• Boiling Point: 309.3°Cat760mmHg
• PKA: 14.36±0.10(Predicted)
• Flash Point: 140.9°C
• PSA: 38.69000
• Density: 1.092g/cm³
• LogP: 1.07430
• Water Solubility.: 35g/L at 20℃
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 182.094294304
• Heavy Atom Count: 13
• Complexity: 111

Purity/Quality:

98% ^*data from raw suppliers

Diethylene Glycol Monophenyl Ether >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Solvents -> Glycol Ethers (E Series)
• Canonical SMILES: C1=CC=C(C=C1)OCCOCCO

Technology Process of 2-(2-Phenoxyethoxy)ethanol

There total 19 articles about 2-(2-Phenoxyethoxy)ethanol 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: 72.0%

2-(2-bromoethoxy)ethan-1-ol (57641-66-4) + phenol (108-95-2,27073-41-2) → 2-(2-phenoxyethoxy)ethanol (104-68-7,9004-78-8)

Guidance literature:

phenol; With potassium hydroxide; In acetonitrile; at 60 ℃; for 2h; Inert atmosphere;

2-(2-bromoethoxy)ethan-1-ol; With potassium iodide; In acetonitrile; at 60 ℃; for 10h; Inert atmosphere;

DOI:10.1021/jm300689c

Reference yield: 70.0%

bromobenzene (108-86-1,52753-63-6) + aniline (62-53-3) + diethylene glycol (111-46-6) → 2-(2-phenoxyethoxy)ethanol (104-68-7,9004-78-8) + diphenylamine (122-39-4)

Guidance literature:

With copper(II) acetate monohydrate; potassium carbonate; at 110 ℃; for 8h; Reagent/catalyst; Catalytic behavior; Inert atmosphere;

DOI:10.1055/s-0039-1690707

Reference yield: 69.0%

oxirane (75-21-8,99932-75-9) + sodium phenoxide (139-02-6) → 2-(2-phenoxyethoxy)ethanol (104-68-7,9004-78-8)

Guidance literature:

at 95 ℃; for 2h;

upstream raw materials:

oxirane

phenol

sodium phenoxide

bis(phenoxyethoxyethyl) peroxydicarbonate

Downstream raw materials:

phenoxyethoxyethyl chloroformate

N-[2-(2-phenoxy-ethoxy)-ethyl]-phthalimide

(3-(3-carbamoyl-1H-pyrrol-1-yl)phenoxycarbonyl)(2-(2-phenoxyethoxy)ethyl)amine

2-(2-phenoxyethoxy)ethanisocyanate

Refernces

• 1、 Chen, Guoliang,Chen, Yuanguang,Du, Fangyu,Fu, Yang,Wu, Ying,Zhou, Qifan. "Copper(ii)-catalyzed c-n coupling of aryl halides and n-nucleophiles promoted by quebrachitol or diethylene glycol". supporting information. p. 2161 - 2168. Retrieved 2019/11/25.
• 2、 Butini, Stefania,Brindisi, Margherita,Gemma, Sandra,Minetti, Patrizia,Cabri, Walter,Gallo, Grazia,Vincenti, Silvia,Talamonti, Emanuela,Borsini, Franco,Caprioli, Antonio,Stasi, Maria Antonietta,Di Serio, Stefano,Ros, Sindu,Borrelli, Giuseppe,Maramai, Samuele,Fezza, Filomena,Campiani, Giuseppe,MacCarrone, Mauro. "Discovery of potent inhibitors of human and mouse fatty acid amide hydrolases". experimental part. p. 6898 - 6915. Retrieved 2012/09/22.