Stannane, tributyl(3-nitrophenyl)-

Base Information

• Chemical Name: Stannane, tributyl(3-nitrophenyl)-
• CAS No.: 79048-31-0
• Molecular Formula: C18H31NO2Sn
• Molecular Weight: 412.16
• DSSTox Substance ID: DTXSID00458183
• Mol file: 79048-31-0.mol

Synonyms:Stannane, tributyl(3-nitrophenyl)-;79048-31-0;3-nitrophenyl tributyl stannane;SCHEMBL2921060;DTXSID00458183;BDZSZSWGXQZIFR-UHFFFAOYSA-N

Chemical Property of Stannane, tributyl(3-nitrophenyl)-

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 413.137682
• Heavy Atom Count: 22
• Complexity: 295

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of Stannane, tributyl(3-nitrophenyl)-

There total 5 articles about Stannane, tributyl(3-nitrophenyl)- 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: 65.0%

m-iodonitrobenzene (645-00-1) + bis(tri-n-butyltin) (813-19-4) → tributyl(3-nitrophenyl)stannane (79048-31-0)

Guidance literature:

tetrakis(triphenylphosphine) palladium⁽⁰⁾; In toluene; byproducts: (C4H9)3SnI; soln. of Bu3SnSnBu3, Pd(PPh3)4, aryl iodide in toluene heated to 60°C for 72 h under Ar; evapd., washed with aq. KF, extd. (C6H6), dried over Na2SO4, chromd. (SiO2, hexane); elem. anal.;

DOI:10.1246/bcsj.56.3855

Reference yield: 60.0%

m-nitrobenzene boronic acid (13331-27-6) + tributyltin methoxide (1067-52-3) → tributyl(3-nitrophenyl)stannane (79048-31-0)

Guidance literature:

In neat (no solvent); at 100 ℃; for 1h; Inert atmosphere;

DOI:10.1016/j.tet.2015.01.048

Reference yield: 59.0%

m-nitrobromobenzene (585-79-5) + bis(tri-n-butyltin) (813-19-4) → tributyl(3-nitrophenyl)stannane (79048-31-0)

Guidance literature:

With palladium diacetate; tricyclohexylphosphine; In neat (no solvent); at 110 ℃; for 24h; under 760.051 Torr; Sealed tube;

DOI:10.1002/ejoc.201701463

upstream raw materials:

m-iodonitrobenzene

bis(tri-n-butyltin)

m-nitrobromobenzene

m-nitrobenzene boronic acid

Downstream raw materials:

3-nitrobenzophenone

3-(3-nitrophenyl)-1,2,4-triazine

2-(3-nitrophenyl)pyrimidine

1-(3-nitrophenyl)propan-2-one

Refernces

• 1、 -. "Method for converting substituted sodium aryl sulfonate to aryl tri-n-butyltin". Paragraph 0104-0108. . Retrieved 2018/12/14.
• 2、 Oikawa, Asuka,Kindaichi, Gan,Shimotori, Yasutaka,Okimoto, Mitsuhiro,Hoshi, Masayuki. "Simple preparation of aryltributylstannanes and its application to one-pot synthesis of diaryl ketones". supporting information. p. 1705 - 1711. Retrieved 2015/03/30.