[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl)phenyl] diphenylphosphine

Base Information

• Chemical Name: [4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl)phenyl] diphenylphosphine
• CAS No.: 462996-04-9
• Molecular Formula: C28H18F17P
• Molecular Weight: 708.398
• DSSTox Substance ID: DTXSID80465315
• Nikkaji Number: J2.137.700G
• Wikidata: Q82291155
• Mol file: 462996-04-9.mol

Synonyms:462996-04-9;[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl)phenyl] diphenylphosphine;[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)phenyl]-diphenylphosphane;SCHEMBL485743;DTXSID80465315;(4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)phenyl)diphenylphosphine;NS00111588;diphenyl-[4-(1 h,1 h,2h,2h-perfluorodecyl)phenyl]phosphine;[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl)phenyl] diphenylphosphine, >=99%

Chemical Property of [4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl)phenyl] diphenylphosphine

Chemical Property:

• Vapor Pressure: 3.39E-08mmHg at 25°C
• Melting Point: 81-85oC
• Boiling Point: 459.7oC at 760 mmHg
• Flash Point: 231.8oC
• PSA: 13.59000
• LogP: 9.38680
• XLogP3: 11
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 12
• Exact Mass: 708.0874663
• Heavy Atom Count: 46
• Complexity: 971

Purity/Quality:

98%,99%, ^*data from raw suppliers

[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl)phenyl] diphenylphosphine ≥99% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=C(C=C3)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Technology Process of [4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl)phenyl] diphenylphosphine

There total 3 articles about [4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl)phenyl] diphenylphosphine 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:

Diphenyl-[4-(1H,1H,2H,2H-perfluorodecyl)phenyl]phosphine oxide (851869-38-0) → bis-phenyl-[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)phenyl]phosphine (462996-04-9)

Guidance literature:

With alane-N,N-dimethylamine; In toluene; at 90 ℃; for 3h;

DOI:10.1016/S0040-4020(02)00205-3

Reference yield:

chloro-diphenylphosphine (1079-66-9,74391-44-9) → bis-phenyl-[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)phenyl]phosphine (462996-04-9)

Guidance literature:

Multi-step reaction with 2 steps

1.1: t-BuLi / diethyl ether; pentane / 1 h / -40 °C

1.2: diethyl ether; pentane / -40 - 20 °C

2.1: 0.88 g / alane-N,N-dimethylamine / toluene / 3 h / 90 °C

With alane-N,N-dimethylamine; tert.-butyl lithium; In diethyl ether; toluene; pentane;

DOI:10.1016/S0040-4020(02)00205-3

Reference yield:

1-(4'-bromophenyl)-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecane (195324-88-0) → bis-phenyl-[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)phenyl]phosphine (462996-04-9)

Guidance literature:

Multi-step reaction with 2 steps

1.1: t-BuLi / diethyl ether; pentane / 1 h / -40 °C

1.2: diethyl ether; pentane / -40 - 20 °C

2.1: 0.88 g / alane-N,N-dimethylamine / toluene / 3 h / 90 °C

With alane-N,N-dimethylamine; tert.-butyl lithium; In diethyl ether; toluene; pentane;

DOI:10.1016/S0040-4020(02)00205-3

upstream raw materials:

Diphenyl-[4-(1H,1H,2H,2H-perfluorodecyl)phenyl]phosphine oxide

chloro-diphenylphosphine

1-(4'-bromophenyl)-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecane

Downstream raw materials:

[Ru(η6-4-phenyl-2-butanol)Cl2(PPh2(p-C6H4C2H4C8H17))]

[Ru(η6-p-cymene)Cl2(PPh2(p-C6H4C2H4C8H17))]

Diphenyl-[4-(1H,1H,2H,2H-perfluorodecyl)phenyl]phosphine oxide

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