5-Ethyl-1,2,3-trifluorobenzene

Base Information

• Chemical Name: 5-Ethyl-1,2,3-trifluorobenzene
• CAS No.: 923033-05-0
• Molecular Formula: C8H7F3
• Molecular Weight: 160.139
• DSSTox Substance ID: DTXSID50597596
• Wikidata: Q82493207
• Mol file: 923033-05-0.mol

Synonyms:5-ethyl-1,2,3-trifluorobenzene;923033-05-0;SCHEMBL391498;DTXSID50597596

Chemical Property of 5-Ethyl-1,2,3-trifluorobenzene

Chemical Property:

• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 160.04998471
• Heavy Atom Count: 11
• Complexity: 115

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC(=C(C(=C1)F)F)F

Technology Process of 5-Ethyl-1,2,3-trifluorobenzene

There total 1 articles about 5-Ethyl-1,2,3-trifluorobenzene 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:

5-(1-bromoethyl)-1,2,3-trifluorobenzene (923033-03-8) → 5-ethyl-1,2,3-trifluorobenzene (923033-05-0)

Guidance literature:

With triethylsilane; palladium dichloride; at 20 ℃; for 22h;

Reference yield: 79.0%

5-ethyl-1,2,3-trifluorobenzene (923033-05-0) → 1-ethyl-3,4,5-trifluoro-2-nitrobenzene (923033-07-2)

Guidance literature:

With sulfuric acid; nitric acid; In water; at 0 - 20 ℃; for 16h;

upstream raw materials:

5-(1-bromoethyl)-1,2,3-trifluorobenzene

Downstream raw materials:

1-ethyl-3,4,5-trifluoro-2-nitrobenzene