Ethanone, 1-phenyl-2-(tributylstannyl)-

Base Information

• Chemical Name: Ethanone, 1-phenyl-2-(tributylstannyl)-
• CAS No.: 17851-99-9
• Molecular Formula: C20H34OSn
• Molecular Weight: 409.199
• DSSTox Substance ID: DTXSID20446643
• Mol file: 17851-99-9.mol

Synonyms:Ethanone, 1-phenyl-2-(tributylstannyl)-;17851-99-9;1-phenyl-2-tributylstannylethanone;DTXSID20446643

Chemical Property of Ethanone, 1-phenyl-2-(tributylstannyl)-

Chemical Property:

• PSA: 0.00000
• LogP: 6.03340
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 12
• Exact Mass: 410.163168
• Heavy Atom Count: 22
• Complexity: 272

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCC[Sn](CCCC)(CCCC)CC(=O)C1=CC=CC=C1

Technology Process of Ethanone, 1-phenyl-2-(tributylstannyl)-

There total 11 articles about Ethanone, 1-phenyl-2-(tributylstannyl)- 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: 50.0%

1-tributylstannanyl-propan-2-one (14583-98-3) + acetophenone (98-86-2) → 1-phenyl-2-tributylstannyl-1-ethanone (17851-99-9) + 1-phenyl-1-(tributylstannyloxy)ethene (17851-98-8)

Guidance literature:

byproducts: CH3COCH3; equimolar amts. of educts; heating to 120°C/400 Torr for 40 h; mixt. of products in ratio of 22:78;

Reference yield: 42.0%

tri-n-butyl(cyanomethyl)stannane (17729-59-8) + acetophenone (98-86-2) → 1-phenyl-2-tributylstannyl-1-ethanone (17851-99-9) + 1-phenyl-1-(tributylstannyloxy)ethene (17851-98-8)

Guidance literature:

at 120°C/400 Torr for 20 h; mixt. of products in ratio of 22:78;

Reference yield:

tributyltin chloride (1461-22-9) → 1-phenyl-2-tributylstannyl-1-ethanone (17851-99-9)

Guidance literature:

With acetophenone; lithium diisopropyl amide; In tetrahydrofuran; byproducts: LiCl; C6H5COCH3 treated with lithium diisopropylamide at 0°C in THF, Sn compd. added, reacted for 10 min; THF removed (vac.), C6D6 added, centrifuged, not isolated, detected by NMR;

DOI:10.1021/ja00372a043

upstream raw materials:

1-acetoxy-1-phenylethene

tributyltin methoxide

tri-n-butyl-tin hydride

2-diazo-acetophenone

Downstream raw materials:

1-phenylpentane-1,4-dione

ethyl 3-benzoylpropanoate

4-chloro-3-hydroxy-1,3-diphenylbutan-1-one

4-methyl-2-phenylfuran