2-Fluoroanthracene

Base Information

• Chemical Name: 2-Fluoroanthracene
• CAS No.: 21454-60-4
• Molecular Formula: C14H9 F
• Molecular Weight: 196.224
• Hs Code.: 2903999090
• DSSTox Substance ID: DTXSID40475935
• Nikkaji Number: J880.693D
• Wikidata: Q82306768
• Mol file: 21454-60-4.mol

Synonyms:2-FLUOROANTHRACENE;21454-60-4;SCHEMBL8789837;DTXSID40475935;AKOS006276041

Chemical Property of 2-Fluoroanthracene

Chemical Property:

• Melting Point: 212 °C(Solv: chloroform (67-66-3))
• Boiling Point: 340.9±11.0 °C(Predicted)
• PSA: 0.00000
• Density: 1.212±0.06 g/cm3(Predicted)
• LogP: 4.13210
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 196.068828449
• Heavy Atom Count: 15
• Complexity: 225

Purity/Quality:

99% ^*data from raw suppliers

2-FLUOROANTHRACENE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C=C3C=C(C=CC3=CC2=C1)F

Technology Process of 2-Fluoroanthracene

There total 8 articles about 2-Fluoroanthracene 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: 86.0%

2-fluoroanthraquinone (572-84-9) → 2-Fluoroanthracene (21454-60-4)

Guidance literature:

2-fluoroanthraquinone; In acetic acid; for 60h; Heating;

With iodine; In toluene; Further stages.; Heating;

DOI:10.1021/jo020497q

Reference yield: 84.0%

iodobenzene (591-50-4) + 5-fluoro-2-methylbenzaldehyde (22062-53-9) → 2-Fluoroanthracene (21454-60-4)

Guidance literature:

With trifluorormethanesulfonic acid; palladium diacetate; silver trifluoroacetate; acetic acid; glycine; at 100 ℃; for 24h; Sealed tube;

DOI:10.1016/j.tet.2019.06.036

Reference yield: 45.0%

2-(4-fluorobenzyl)benzaldehyde → 2-Fluoroanthracene (21454-60-4)

Guidance literature:

With trifluorormethanesulfonic acid; at 0 - 20 ℃; for 18h; Reflux;

DOI:10.1002/ejoc.201601406

upstream raw materials:

2-aminoanthracene

2-fluoroanthraquinone

2-aminoanthraquinone

4-fluoroboronic acid

Downstream raw materials:

1-[9'-(2'-fluoroanthryl)]-2,2-dimesitylvinyl acetate

1-[9'-(2'-fluoroanthryl)]-2,2-dimesitylethenol