Ethyl 2-(3-bromophenyl)acetate

Base Information

• Chemical Name: Ethyl 2-(3-bromophenyl)acetate
• CAS No.: 14062-30-7
• Molecular Formula: C10H11BrO2
• Molecular Weight: 243.1
• Hs Code.: 2916399090
• DSSTox Substance ID: DTXSID40466949
• Nikkaji Number: J472.806H
• Wikidata: Q82293630
• Mol file: 14062-30-7.mol

Synonyms:Ethyl 2-(3-bromophenyl)acetate;14062-30-7;Ethyl 3-Bromophenylacetate;Benzeneacetic acid, 3-bromo-, ethyl ester;Ethyl2-(3-Bromophenyl)acetate;MFCD09953130;ethyl (3-bromophenyl)acetate;ethyl [3-bromophenyl]acetate;(3-bromo-phenyl)-acetic acid ethyl ester;ethyl(3-bromophenyl)acetate;Ethyl (3-bromophenyI)acetate;SCHEMBL788672;ethyl (3-bromo-phenyl)acetate;DTXSID40466949;CAERSDJFKGMKLY-UHFFFAOYSA-N;AB3725;AKOS011268643;AC-7170;CS-W006014;GS-4244;SY004525;AM20020474;FT-0649914;FT-0700691;A885811

Chemical Property of Ethyl 2-(3-bromophenyl)acetate

Chemical Property:

• Vapor Pressure: 0.003mmHg at 25°C
• Boiling Point: 285.137°C at 760 mmHg
• Flash Point: 126.247°C
• PSA: 26.30000
• Density: 1.39g/cm³
• LogP: 2.55470
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 241.99424
• Heavy Atom Count: 13
• Complexity: 170

Purity/Quality:

97% ^*data from raw suppliers

Ethyl2-(3-Bromophenyl)acetate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CC1=CC(=CC=C1)Br

Technology Process of Ethyl 2-(3-bromophenyl)acetate

There total 9 articles about Ethyl 2-(3-bromophenyl)acetate 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: 98.0%

ethanol (64-17-5) + 3-Bromophenylacetic acid (1878-67-7) → ethyl 2-(3-bromophenyl)acetate (14062-30-7)

Guidance literature:

With sulfuric acid; for 96h; Heating;

DOI:10.1021/jm990448e

Reference yield: 93.0%

3-Bromophenylacetic acid (1878-67-7) → ethyl 2-(3-bromophenyl)acetate (14062-30-7)

Guidance literature:

With sulfuric acid; In ethanol; Reflux;

Reference yield: 88.0%

(3-bromophenyl)boronic acid (89598-96-9) + glycine ethyl ester hydrochloride (623-33-6) → ethyl 2-(3-bromophenyl)acetate (14062-30-7)

Guidance literature:

With ammonium chloride; sodium nitrite; In water; toluene; at 100 ℃; for 24h; Schlenk technique;

DOI:10.1002/anie.201406765

upstream raw materials:

ethanol

(3-bromophenyl)acetonitrile

3-Bromophenylacetic acid

ethyl iodide

Downstream raw materials:

m-ethenylphenylacetic acid ethyl ester

ethyl 4-(3-bromophenyl)-3,4,5,6-tetrahydro-2H-pyran-4-carboxylate

(3-bromomethylphenyl)acetic acid ethyl ester

ethyl 2-(3-formylphenyl)acetate