Ethyl 2-(6-bromopyridin-2-YL)acetate

Base Information

• Chemical Name: Ethyl 2-(6-bromopyridin-2-YL)acetate
• CAS No.: 955369-63-8
• Molecular Formula: C₉H₁₀BrNO₂
• Molecular Weight: 244.088
• Hs Code.: 2933399990
• European Community (EC) Number: 837-026-4
• DSSTox Substance ID: DTXSID20697512
• Wikidata: Q82627430
• Mol file: 955369-63-8.mol

Synonyms:ETHYL 2-(6-BROMOPYRIDIN-2-YL)ACETATE;955369-63-8;(6-Bromo-pyridin-2-yl)-acetic acid ethyl ester;SCHEMBL3364540;DTXSID20697512;LTRSPLNQOMJCSH-UHFFFAOYSA-N;AMY38183;ethyl (6-bromopyridin-2-yl)acetate;MFCD10566284;AKOS016008832;AB56168;DS-4902;ETHYL2-(6-BROMOPYRIDIN-2-YL)ACETATE;FT-0749504;C77298;EN300-227473;A849342;(6-BROMOPYRIDIN-2-YL)ACETIC ACID ETHYL ESTER

Chemical Property of Ethyl 2-(6-bromopyridin-2-YL)acetate

Chemical Property:

• Boiling Point: 297.4±25.0 °C(Predicted)
• PKA: -0.03±0.12(Predicted)
• Density: 1.451±0.06 g/cm3(Predicted)
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 242.98949
• Heavy Atom Count: 13
• Complexity: 175

Purity/Quality:

97% ^*data from raw suppliers

Ethyl2-(6-bromopyridin-2-yl)acetate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of Ethyl 2-(6-bromopyridin-2-YL)acetate

There total 5 articles about Ethyl 2-(6-bromopyridin-2-YL)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: 100.0%

2-bromo-6-methylpyridine (5315-25-3) + Diethyl carbonate (105-58-8,76619-83-5) → (6-bromo-pyridin-2-yl)-acetic acid ethyl ester (955369-63-8)

Guidance literature:

With n-butyllithium; diisopropylamine; In tetrahydrofuran; at -60 - -40 ℃; for 16h;

DOI:10.1021/acs.joc.8b01156

Reference yield: 86.0%

2-bromo-6-methylpyridine (5315-25-3) + chloroformic acid ethyl ester (541-41-3) → (6-bromo-pyridin-2-yl)-acetic acid ethyl ester (955369-63-8)

Guidance literature:

2-bromo-6-methylpyridine; With n-butyllithium; diisopropylamine; In tetrahydrofuran; hexane; at -78 ℃; for 0.5h;

chloroformic acid ethyl ester; In tetrahydrofuran; hexane; at -78 ℃; for 0.5h;

DOI:10.1002/anie.201907206

Reference yield: 82.0%

ethanol (64-17-5) + 2-(6-Bromo-pyridin-2-yl)-malonic acid diethyl ester (1387560-41-9) → (6-bromo-pyridin-2-yl)-acetic acid ethyl ester (955369-63-8)

Guidance literature:

With sulfuric acid; for 12h; Reflux;

upstream raw materials:

2-bromo-6-methylpyridine

ethanol

2-(6-Bromo-pyridin-2-yl)-malonic acid diethyl ester

diisopropylamine

Downstream raw materials:

2-(6-bromopyridin-2-yl)acetic acid

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