Ethyl 2-(5-bromo-2-formylphenoxy)acetate

Base Information

• Chemical Name: Ethyl 2-(5-bromo-2-formylphenoxy)acetate
• CAS No.: 942414-81-5
• Molecular Formula: C11H11BrO4
• Molecular Weight: 287.11
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID40443210
• Wikidata: Q82260928
• Mol file: 942414-81-5.mol

Synonyms:Ethyl 2-(5-bromo-2-formylphenoxy)acetate;942414-81-5;2-(5-Bromo-2-formylphenoxy)acetic Acid Ethyl Ester;DTXSID40443210;AKOS016007066;CS-T-49742;Ethyl2-(5-bromo-2-formylphenoxy)acetate;AC-27184;FT-0720014

Chemical Property of Ethyl 2-(5-bromo-2-formylphenoxy)acetate

Chemical Property:

• PSA: 52.60000
• LogP: 2.20350
• Storage Temp.: 2-8°C
• Solubility.: Chloroform, DImethyl Sulfoxide, Methanol
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 285.98407
• Heavy Atom Count: 16
• Complexity: 244

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-(5-Bromo-2-formylphenoxy)aceticAcidEthylEster ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)COC1=C(C=CC(=C1)Br)C=O
• Uses: Intermediate in the synthesis of carbamoyl-substituted isoindolone.

Technology Process of Ethyl 2-(5-bromo-2-formylphenoxy)acetate

There total 7 articles about Ethyl 2-(5-bromo-2-formylphenoxy)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:

4-bromosalicylaldehyde (22532-62-3) + ethyl bromoacetate (105-36-2) → (5-Bromo-2-formyl-phenoxy)-acetic acid ethyl ester (942414-81-5)

Guidance literature:

With potassium carbonate; sodium iodide;

DOI:10.1021/jm970020k

Reference yield:

3-Bromophenol (591-20-8) → (5-Bromo-2-formyl-phenoxy)-acetic acid ethyl ester (942414-81-5)

Guidance literature:

Multi-step reaction with 7 steps

1: 1.) NaH / 2.) 175 deg C, 1900 psi

2: H₂SO₄

3: NaH

4: LiAlH₄

5: MnO₂

6: p-TsOH, water / dioxane

7: K₂CO₃, NaI

With manganese(IV) oxide; lithium aluminium tetrahydride; sulfuric acid; water; sodium hydride; potassium carbonate; toluene-4-sulfonic acid; sodium iodide; In 1,4-dioxane;

DOI:10.1021/jm970020k

Reference yield:

4-bromosalicylic acid (1666-28-0) → (5-Bromo-2-formyl-phenoxy)-acetic acid ethyl ester (942414-81-5)

Guidance literature:

Multi-step reaction with 6 steps

1: H₂SO₄

2: NaH

3: LiAlH₄

4: MnO₂

5: p-TsOH, water / dioxane

6: K₂CO₃, NaI

With manganese(IV) oxide; lithium aluminium tetrahydride; sulfuric acid; water; sodium hydride; potassium carbonate; toluene-4-sulfonic acid; sodium iodide; In 1,4-dioxane;

DOI:10.1021/jm970020k

upstream raw materials:

4-bromosalicylaldehyde

ethyl bromoacetate

3-Bromophenol

4-bromosalicylic acid

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