2-Phenylfluoranthene

Base Information

• Chemical Name: 2-Phenylfluoranthene
• CAS No.: 4914-78-7
• Molecular Formula: C₂₂H₁₄
• Molecular Weight: 278.353
• DSSTox Substance ID: DTXSID90698617
• Wikidata: Q82628941
• Mol file: 4914-78-7.mol

Synonyms:2-PHENYLFLUORANTHENE;4914-78-7;DTXSID90698617;JFNJAZGGEAAZNG-UHFFFAOYSA-N

Chemical Property of 2-Phenylfluoranthene

Chemical Property:

• PSA: 0.00000
• LogP: 6.15420
• XLogP3: 6.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 278.109550447
• Heavy Atom Count: 22
• Complexity: 393

Purity/Quality:

99%min ^*data from raw suppliers

2-PHENYLFLUORANTHENE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC3=C4C(=C2)C=CC=C4C5=CC=CC=C53

Technology Process of 2-Phenylfluoranthene

There total 6 articles about 2-Phenylfluoranthene 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:

fluoranthene (206-44-0) + phenyltin trichloride (1124-19-2) → 3,4-diphenylfluoranthene (1022915-92-9) + 2,4-diphenylfluoranthene (1022915-94-1) + 3-phenylfluoranthene (4995-81-7) + 2-phenylfluoranthene (4914-78-7)

Guidance literature:

With copper dichloride; palladium dichloride; In 1,2-dichloro-ethane; at 80 ℃; for 16h; Further byproducts. Title compound not separated from byproducts.;

DOI:10.1039/b717251f

Reference yield:

trimethylphenylsilane (768-32-1) + fluoranthene (206-44-0) → 3,4-diphenylfluoranthene (1022915-92-9) + 2,4-diphenylfluoranthene (1022915-94-1) + 3-phenylfluoranthene (4995-81-7) + 2-phenylfluoranthene (4914-78-7)

Guidance literature:

With copper dichloride; palladium dichloride; In 1,2-dichloro-ethane; at 80 ℃; for 16h;

DOI:10.1246/cl.2011.1050

Reference yield:

methyl 9H-fluorene-9-carboxylate (3002-30-0) → 2-phenylfluoranthene (4914-78-7)

Guidance literature:

Multi-step reaction with 4 steps

1: Na, MeOH

2: aq. KOH

3: (i) SOCl₂, (ii) AlCl₃

4: (i) (reduction), (ii) chloranil

With methanol; potassium hydroxide; sodium;

DOI:10.1039/JR9650005737

upstream raw materials:

2-Phenyl-1,2,3,10b-tetrahydrofluoranthen-3-on

methyl 9H-fluorene-9-carboxylate

α-Phenyl-β-(9-fluorenyl)propionsaeure

Aethyl-α-phenyl-β-(9-methoxycarbonyl-9-fluorenyl)propionat

Refernces

• 1、 Kawai, Hiroshi,Kobayashi, Yasuhiro,Oi, Shuichi,Inoue, Yoshio. "Direct C-H bond arylation of arenes with aryltin reagents catalysed by palladium complexes". . p. 1464 - 1466. Retrieved 2008/12/21.