Dimethyl(pentafluorophenyl)borane

Base Information

• Chemical Name: Dimethyl(pentafluorophenyl)borane
• CAS No.: 363596-54-7
• Molecular Formula: C8H6BF5
• Molecular Weight: 207.939
• DSSTox Substance ID: DTXSID00573587
• Nikkaji Number: J1.579.596D
• Wikidata: Q82462340
• Mol file: 363596-54-7.mol

Synonyms:363596-54-7;Dimethyl(pentafluorophenyl)borane;SCHEMBL1266057;DTXSID00573587

Chemical Property of Dimethyl(pentafluorophenyl)borane

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 208.0482712
• Heavy Atom Count: 14
• Complexity: 184

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C)(C)C1=C(C(=C(C(=C1F)F)F)F)F

Technology Process of Dimethyl(pentafluorophenyl)borane

There total 11 articles about Dimethyl(pentafluorophenyl)borane 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:

tris(pentafluorophenyl)borate (1109-15-5) + dimethyl zinc(II) (544-97-8) → dimethylpentafluorophenylborane (363596-54-7) + trimethylborane (593-90-8) + bis(pentafluorophenyl)zinc (1799-90-2)

Guidance literature:

In ⁽²⁾H₈-toluene; not isolated, identified by NMR;

DOI:10.1021/om0103557

Reference yield:

tris(pentafluorophenyl)borate (1109-15-5) + dimethyl zinc(II) (544-97-8) → dimethylpentafluorophenylborane (363596-54-7) + trimethylborane (593-90-8) + bis(pentafluorophenyl)zinc (1799-90-2) + methylbis(pentafluorophenyl)borane (170151-48-1)

Guidance literature:

In ⁽²⁾H₈-toluene; soln. B(C6F5)3 in toluene-d8/1,2-difluorobenzene was treated with soln.ZnMe2 in toluene-d8; not isolated, identified by NMR;

DOI:10.1021/om0103557

Reference yield:

(Si(CH3)2(((CH3)3Si)2SiO)2)Ti(CH3)2 + tris(pentafluorophenyl)borate (1109-15-5) → dimethylpentafluorophenylborane (363596-54-7) + trimethylborane (593-90-8) + (Si(CH3)2(((CH3)3Si)2SiO)2)Ti(C6F5)2 + (Si(CH3)2(((CH3)3Si)2SiO)2)TiCH3(1+)*CH3B(C6F5)3(1-)=(Si(CH3)2(((CH3)3Si)2SiO)2)TiCH3B(C6F5)3CH3 + methylbis(pentafluorophenyl)borane (170151-48-1)

Guidance literature:

In benzene-d6; (Ar, Schlenk) a NMR-tube was charged with complex and B(C6F5)3, dissolved in C6D6 at room temp., 5 min to 6 days; detected by NMR spectra;

DOI:10.1021/ic0514997

upstream raw materials:

bis(2,2,6,6-tetramethylpiperidino)methylaluminium

tris(pentafluorophenyl)borate

dimethyl zinc(II)

[In(CH₃)(N,N'-diisopropylaminotroponiminate)][B(CH₃)(C₆F₅)3]