3-Fluorophenyllithium

Base Information

• Chemical Name: 3-Fluorophenyllithium
• CAS No.: 107337-71-3
• Molecular Formula: C6H4FLi
• Molecular Weight: 102.037
• DSSTox Substance ID: DTXSID00544358

Synonyms:3-Fluorophenyllithium;5-fluorophenyl lithium;107337-71-3;Lithium 3-fluorobenzen-1-ide;SCHEMBL4357720;DTXSID00544358;GACSZFRRPCIAPN-UHFFFAOYSA-N

Chemical Property of 3-Fluorophenyllithium

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 102.04570672
• Heavy Atom Count: 8
• Complexity: 145

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [Li+].C1=C[C-]=CC(=C1)F

Technology Process of 3-Fluorophenyllithium

There total 2 articles about 3-Fluorophenyllithium 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:

3-fluorobromobenzene (1073-06-9) → 3-fluorophenyllithium (107337-71-3)

Guidance literature:

With n-butyllithium; decane; In hexane; at 40 ℃; rate of reaction relative to unsubstituted bromobenzene;

DOI:10.1021/ja00366a024

Reference yield:

4-chlorophenyl lithium (14774-78-8) → 3-fluorophenyllithium (107337-71-3)

Guidance literature:

In tetrahydrofuran; biphenyl; pentane; at -75.16 ℃; Equilibrium constant; Inert atmosphere;

DOI:10.1021/jo8020083

Reference yield: 77.0%

1-methyl-5-phenylpyrimidine-2(1H)-thione (1609637-35-5) + 3-fluorophenyllithium (107337-71-3) → (±)-4-(3-fluorophenyl)-3,4-dihydro-1-methyl-5-phenylpyrimidine-2(1H)-thione (1609637-56-0)

Guidance literature:

In tetrahydrofuran; at 0 ℃; for 0.5h; regioselective reaction; Schlenk technique; Inert atmosphere;

DOI:10.1039/c4ob00094c

upstream raw materials:

3-fluorobromobenzene

4-chlorophenyl lithium

Downstream raw materials:

Benzyl-bis-(3-fluoro-phenyl)-phosphane

(4-Bromo-thiophen-2-yl)-(3-fluoro-phenyl)-methanol

2,3,4,5-tetrakis-(3,5-dimethyl-phenyl)-1-(3-fluoro-phenyl)-cyclopenta-2,4-dienol

(3-fluorophenyl)(6-(4-methylthiophenyl)(2H-benzo[d]1,3-dioxolan-5-yl))methan-1-ol

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