Tributylstannanylium;trifluoromethanesulfonate

Base Information

• Chemical Name: Tributylstannanylium;trifluoromethanesulfonate
• CAS No.: 68725-14-4
• Molecular Formula: C13H27F3O3SSn
• Molecular Weight: 439.127
• Hs Code.: 29312000
• DSSTox Substance ID: DTXSID40475197
• Mol file: 68725-14-4.mol

Synonyms:tributylstannanylium;trifluoromethanesulfonate;SCHEMBL9365930;DTXSID40475197;AKOS027470123;tri-n-Butyl(trifluoromethane-sulfonate)tin;FT-0721100

Chemical Property of Tributylstannanylium;trifluoromethanesulfonate

Chemical Property:

• Vapor Pressure: 0.000161mmHg at 25°C
• Melting Point: 31 °C
• Boiling Point: 56 °C
• Flash Point: >230 °F
• PSA: 51.75000
• LogP: 6.27920
• Storage Temp.: 2-8°C
• Sensitive.: Moisture Sensitive
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 440.065503
• Heavy Atom Count: 21
• Complexity: 217

Purity/Quality:

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

Tri-n-butyltin trifluoromethanesulfonate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T,N
• Hazard Codes: T,N
• Statements: 21-25-36/38-48/23/25-50/53
• Safety Statements: 35-36/37/39-45-60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC[Sn+](CCCC)CCCC.C(F)(F)(F)S(=O)(=O)[O-]

Technology Process of Tributylstannanylium;trifluoromethanesulfonate

There total 2 articles about Tributylstannanylium;trifluoromethanesulfonate 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: 54.0%

μ-oxobis[(trifluoromethanesulfonato)(phenyl)iodine] (88016-29-9) + 4,4-dimethyl-1-(tributylstannyl)-2-pentyne (144241-73-6) → t-butylallene (26981-77-1) + 4,4-dimethyl-1-(2-iodophenyl)-2-pentyne (131251-47-3) + tributylstannyl trifluoromethanesulfonate (68725-14-4)

Guidance literature:

In chloroform; at -30 ℃;

DOI:10.1021/jo00050a024

Reference yield:

tri-n-butyl-tin hydride (688-73-3) + (N(CH3)2)C6H4CHC6H4(N(CH3)2)(1+)*CF3SO3(1-) = CF3SO3{(N(CH3)2)C6H4CHC6H4(N(CH3)2)} (142581-66-6) → 4,4'-methylene-bis(N,N-dimethylaniline) (101-61-1) + tributylstannyl trifluoromethanesulfonate (68725-14-4)

Guidance literature:

In dichloromethane; at -70 ℃; Kinetics; Rate constant; ΔH(excit), ΔS(excit);

Reference yield: 92.0%

tributylstannyl trifluoromethanesulfonate (68725-14-4) + diphenylphosphineborane (41593-58-2) → (C6H5)2P(BH3)((C4H9)3Sn) (1252594-30-1)

Guidance literature:

With 2,2,6,6-tetramethylpiperidine; In dichloromethane; byproducts: H2; N2 or Ar; MeCN soln. of nBu3nOTf (0.55 mmol) and 2,2,6,6-tetramethylpiperidine (0.55 mmol) added to soln. of B compd. (0.5 mmol), mixt. stirredat 20°c for 4 h; ppt. filtered off, evapd.;

DOI:10.1002/ejic.201000515

upstream raw materials:

tri-n-butyl-tin hydride

(N(CH₃)2)C₆H₄CHC₆H₄(N(CH₃)2)⁽¹⁺⁾*CF₃SO₃^(1-) = CF₃SO₃{(N(CH₃)2)C₆H₄CHC₆H₄(N(CH₃)2)}

μ-oxobis[(trifluoromethanesulfonato)(phenyl)iodine]

4,4-dimethyl-1-(tributylstannyl)-2-pentyne

Downstream raw materials:

(Z)-3-(tributylstannanyl)prop-2-en-1-ol

1-tributylstannyl-3-hydroxypropene

tributyl-(4,5-dihydro-furan-2-yl)-stannane

(C₆H₅)2P(BH₃)((C₄H₉)3Sn)