Trimethyl[3-(phenylsulfanyl)heptan-3-yl]silane

Base Information

• Chemical Name: Trimethyl[3-(phenylsulfanyl)heptan-3-yl]silane
• CAS No.: 85969-76-2
• Molecular Formula: C16H28SSi
• Molecular Weight: 280.55
• DSSTox Substance ID: DTXSID70515570
• Mol file: 85969-76-2.mol

Synonyms:85969-76-2;Trimethyl[3-(phenylsulfanyl)heptan-3-yl]silane;DTXSID70515570

Chemical Property of Trimethyl[3-(phenylsulfanyl)heptan-3-yl]silane

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 280.16809860
• Heavy Atom Count: 18
• Complexity: 228

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCC(CC)([Si](C)(C)C)SC1=CC=CC=C1

Technology Process of Trimethyl[3-(phenylsulfanyl)heptan-3-yl]silane

There total 12 articles about Trimethyl[3-(phenylsulfanyl)heptan-3-yl]silane 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: 81.0%

3-phenylsulphonyl-3-trimethylsilylheptane (91787-41-6) → 3-phenylthio-3-trimethylsilylheptane (85969-76-2)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; for 2h; Heating;

DOI:10.1039/P19860000195

Reference yield:

(phenylsulfonylmethyl)trimethylsilane (17872-92-3) → 3-phenylthio-3-trimethylsilylheptane (85969-76-2)

Guidance literature:

Multi-step reaction with 3 steps

1: 80 percent / nBuLi / tetrahydrofuran

2: 73 percent / nBuLi / tetrahydrofuran

3: LiAlH₄

With lithium aluminium tetrahydride; n-butyllithium; In tetrahydrofuran;

DOI:10.1039/c39840000486

Reference yield:

1-phenylsulphonyl-1-trimethylsilylpentane (91787-36-9) → 3-phenylthio-3-trimethylsilylheptane (85969-76-2)

Guidance literature:

Multi-step reaction with 2 steps

1: 73 percent / nBuLi / tetrahydrofuran

2: LiAlH₄

With lithium aluminium tetrahydride; n-butyllithium; In tetrahydrofuran;

DOI:10.1039/c39840000486

upstream raw materials:

1-bromo-butane

1-phenylthio-1-trimethylsilylethene

methyllithium

1-iodo-butane

Downstream raw materials:

heptan-3-one