2-Ethoxy-6-fluorobenzaldehyde

Base Information

• Chemical Name: 2-Ethoxy-6-fluorobenzaldehyde
• CAS No.: 82129-45-1
• Molecular Formula: C₉H₉FO₂
• Molecular Weight: 168.168
• Hs Code.: 2914500090
• European Community (EC) Number: 872-518-2
• Mol file: 82129-45-1.mol

Synonyms:2-ethoxy-6-fluorobenzaldehyde;82129-45-1;SCHEMBL4542715;VHZCPJWEAMDEKL-UHFFFAOYSA-N;MFCD02114885;AKOS022637545;CS-0191460;E89623;EN300-364889;Z1511760465

Chemical Property of 2-Ethoxy-6-fluorobenzaldehyde

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 168.05865769
• Heavy Atom Count: 12
• Complexity: 150

Purity/Quality:

99% ^*data from raw suppliers

2-Ethoxy-6-fluorobenzaldehyde 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC1=C(C(=CC=C1)F)C=O

Technology Process of 2-Ethoxy-6-fluorobenzaldehyde

There total 5 articles about 2-Ethoxy-6-fluorobenzaldehyde 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%

2-fluoro-6-hydroxybenzaldehyde (38226-10-7) + ethyl iodide (75-03-6) → 2-ethoxy-6-fluorobenzaldehyde (82129-45-1)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃;

Reference yield:

1-ethoxy-3-fluorobenzene (458-03-7) → 2-ethoxy-6-fluorobenzaldehyde (82129-45-1)

Guidance literature:

With n-butyllithium; In tetrahydrofuran; diethyl ether; hexane; N,N-dimethyl-formamide;

Reference yield:

1-ethoxy-3-fluorobenzene (458-03-7) + N,N-dimethyl-formamide (68-12-2,33513-42-7) → 2-ethoxy-6-fluorobenzaldehyde (82129-45-1)

Guidance literature:

With n-butyllithium; Yield given. Multistep reaction; 1.) hexane, THF, -65 degC, 0.5 h, 2.) hexane, THF, from -65 deg C to RT;

DOI:10.1021/jm950639r

upstream raw materials:

1-ethoxy-3-fluorobenzene

N,N-dimethyl-formamide

3-fluorophenol

2-fluoro-6-hydroxybenzaldehyde

Downstream raw materials:

2-(2-ethoxy-6-fluorophenyl)-2-trimethylsiloxyethanenitrile

2-(2-ethoxy-6-fluorophenyl)ethylamine

1-(5-Bromo-pyridin-2-yl)-3-[2-(2-ethoxy-6-fluoro-phenyl)-ethyl]-thiourea