Ethyl 2-phenoxybenzoate

Base Information

• Chemical Name: Ethyl 2-phenoxybenzoate
• CAS No.: 41755-76-4
• Molecular Formula: C15H14 O3
• Molecular Weight: 242.274
• Hs Code.: 2918990090
• European Community (EC) Number: 671-398-7
• DSSTox Substance ID: DTXSID30375117
• Wikidata: Q82163652
• Mol file: 41755-76-4.mol

Synonyms:ethyl 2-phenoxybenzoate;41755-76-4;2-Phenoxybenzoic acid ethyl ester;ethyl2-phenoxybenzoate;ethyl-2-phenoxybenzoate;2-Phenoxybenzoicacidethylester;SCHEMBL538560;DTXSID30375117;MFCD03093836;AKOS025402911;A825645

Chemical Property of Ethyl 2-phenoxybenzoate

Chemical Property:

• Vapor Pressure: 0.000118mmHg at 25°C
• Refractive Index: 1.557
• Boiling Point: 143 °C
• Flash Point: 138.8°C
• PSA: 35.53000
• Density: 1.129g/cm³
• LogP: 3.65560
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 242.094294304
• Heavy Atom Count: 18
• Complexity: 259

Purity/Quality:

97% ^*data from raw suppliers

Ethyl 2-phenoxybenzoate 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C1=CC=CC=C1OC2=CC=CC=C2

Technology Process of Ethyl 2-phenoxybenzoate

There total 3 articles about Ethyl 2-phenoxybenzoate 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: 87.0%

ethanol (64-17-5) + 2-phenoxybenzoic acid (2243-42-7) → ethyl 2-phenoxybenzoate (41755-76-4)

Guidance literature:

With sulfuric acid; at 130 ℃; for 0.2h; Sealed tube; Microwave irradiation;

DOI:10.1002/anie.201804628

Reference yield:

sodium hydrogencarbonate (144-55-8) + 2-phenoxybenzoic acid (2243-42-7) → ethyl 2-phenoxybenzoate (41755-76-4)

Guidance literature:

With thionyl chloride; In ethanol; N,N-dimethyl-formamide; benzene;

Reference yield:

→ ethyl 2-phenoxybenzoate (41755-76-4)

Guidance literature:

Phenoxybenzoat, Ethylencarbonat, Me4NCl;

upstream raw materials:

ethanol

2-phenoxybenzoic acid

sodium hydrogencarbonate

Downstream raw materials:

2-phenoxybenzamide

2-phenoxybenzoic acid hydrazide

5-ethoxy-3-(2-phenoxybenzyl)-4H-1,2,4-triazole

2-amino-5-(2-phenoxybenzyl)-1,3,4-oxadiazole