Boranamine, 1-chloro-N-(1,1-dimethylethyl)-1-(pentafluorophenyl)-N-(trimethylsilyl)-

Base Information

• Chemical Name: Boranamine, 1-chloro-N-(1,1-dimethylethyl)-1-(pentafluorophenyl)-N-(trimethylsilyl)-
• CAS No.: 72886-50-1
• Molecular Formula: C₁₃H₁₈BClF₅NSi
• Molecular Weight: 357.634
• DSSTox Substance ID: DTXSID101129339
• Mol file: 72886-50-1.mol

Synonyms:DTXSID101129339;Boranamine, 1-chloro-N-(1,1-dimethylethyl)-1-(pentafluorophenyl)-N-(trimethylsilyl)-;72886-50-1

Chemical Property of Boranamine, 1-chloro-N-(1,1-dimethylethyl)-1-(pentafluorophenyl)-N-(trimethylsilyl)-

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 357.0910248
• Heavy Atom Count: 22
• Complexity: 376

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: B(C1=C(C(=C(C(=C1F)F)F)F)F)(N(C(C)(C)C)[Si](C)(C)C)Cl

Technology Process of Boranamine, 1-chloro-N-(1,1-dimethylethyl)-1-(pentafluorophenyl)-N-(trimethylsilyl)-

There total 2 articles about Boranamine, 1-chloro-N-(1,1-dimethylethyl)-1-(pentafluorophenyl)-N-(trimethylsilyl)- 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: 72.0%

bromopentafluorobenzene (344-04-7) + (tert-butyl(trimethylsilyl)amino)dichloroborane (104172-73-8) → (tert-butyl(trimethylsilyl)amino)chloro(pentafluorophenyl)borane (72886-50-1)

Guidance literature:

With BuLi; In hexane; pentane; addn. of BuLi in hexane to C6F5Br in pentane at -78°C, removal ofthe supernatant by syringe, addn. of pentane, addn. of the borane in pe ntane at -78°C, stirring 1 h at this temp. and 12 h at room temp.; filtration, distn.;

Reference yield: 68.0%

trimethyl(tert-butylamino)silane (5577-67-3) + dichloro(pentafluorophenyl)borane (830-48-8) → (tert-butyl(trimethylsilyl)amino)chloro(pentafluorophenyl)borane (72886-50-1)

Guidance literature:

In hexane;

Reference yield: 90.0%

Isobutyronitrile (78-82-0) + (tert-butyl(trimethylsilyl)amino)chloro(pentafluorophenyl)borane (72886-50-1) → 1,3-di-tert-butyl-1,2,3,4-tetrahydro-6-isopropyl-2,4-bis(pentafluorophenyl)-1,3,5,2,4-triazadiborine (172477-30-4)

Guidance literature:

In dichloromethane; thermolysis of the substituted borane in the gas phase, condensing the product into a vessel containing 2-cyanopropane and CH2Cl2 cooled at -196°C, warming to -30°C, standing (overnight); filtration, crystn. (CH2Cl2); elem. anal.;

upstream raw materials:

trimethyl(tert-butylamino)silane

dichloro(pentafluorophenyl)borane

bromopentafluorobenzene

(tert-butyl(trimethylsilyl)amino)dichloroborane

Downstream raw materials:

1,3-di-tert-butyl-2-pentafluorophenyl-4,4-diphenyl-[1,3,2]diazaboretidine

1,3-di-tert-butyl-2,4-bis(pentafluorophenyl)-1,3,2,4-diazadiboretidine

2-tert-butyl-3-pentafluorophenyl-2-aza-3-bora-bicyclo[2.2.1]hept-5-ene

4-tert-Butyl-2-methyl-3,5-bis-pentafluorophenyl-[1,2,4,3,5]oxadiazadiborolidine