6-fluorobenzo(a)pyrene

Base Information

• Chemical Name: 6-fluorobenzo(a)pyrene
• CAS No.: 59417-86-6
• Molecular Formula: C20H11F
• Molecular Weight: 270.306
• Mol file: 59417-86-6.mol

Synonyms:Benzo(a)pyrene,6-fluoro;6-Fluorobenzo(a)pyrene;

Chemical Property of 6-fluorobenzo(a)pyrene

Chemical Property:

• Vapor Pressure: 1.44E-08mmHg at 25°C
• Melting Point: 167-169 °C(Solv: acetone (67-64-1); methanol (67-56-1))
• Refractive Index: 1.7300 (estimate)
• Boiling Point: 470.4°Cat760mmHg
• Flash Point: 203.5°C
• PSA: 0.00000
• Density: 1.349g/cm³
• LogP: 5.87630

Purity/Quality:

99% ^*data from raw suppliers

6-FLUOROBENZO(A)PYRENE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 6-fluorobenzo(a)pyrene

There total 3 articles about 6-fluorobenzo(a)pyrene 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: 25.0%

Benzopyrene radical cation perchlorate → benzopyrene (50-32-8,42299-33-2,34505-58-3) + 6-fluorobenzopyrene (59417-86-6)

Guidance literature:

With Tetramethylammonium dihydrogen trifluoride; In acetonitrile; for 1h;

DOI:10.1021/jo00104a024

Reference yield: 20.0%

Benzopyrene radical cation tetrafluoroborate → benzopyrene (50-32-8,42299-33-2,34505-58-3) + 6-fluorobenzopyrene (59417-86-6)

Guidance literature:

With Tetramethylammonium dihydrogen trifluoride; In acetonitrile; for 1h;

DOI:10.1021/jo00104a024

Reference yield:

C20H11F(1+)*ClO4(1-) → benzo[a]pyrene-6,12-dione (3067-12-7,64133-80-8) + benzo[a]pyrene-1,6-quinone (3067-13-8) + benzo[a]pyrene-3,6-dione (3067-14-9) + 6-fluorobenzopyrene (59417-86-6)

Guidance literature:

With sodium acetate; for 0.25h; Yield given. Further byproducts given. Yields of byproduct given. Title compound not separated from byproducts;

DOI:10.1021/jo00104a024

Downstream raw materials:

benzo[a]pyrene-6,12-dione

benzopyren-6-yl acetate

benzo[a]pyrene-1,6-quinone

benzo[a]pyrene-3,6-dione

Refernces