1,2,5-Trimethyl-2,3-diphenyl-1,3,5,2-triazasilepane-4-thione

Base Information

• Chemical Name: 1,2,5-Trimethyl-2,3-diphenyl-1,3,5,2-triazasilepane-4-thione
• CAS No.: 138767-59-6
• Molecular Formula: C₁₈H₂₃N₃SSi
• Molecular Weight: 341.552
• DSSTox Substance ID: DTXSID10577314

Synonyms:138767-59-6;1,2,5-Trimethyl-2,3-diphenyl-1,3,5,2-triazasilepane-4-thione;DTXSID10577314

Chemical Property of 1,2,5-Trimethyl-2,3-diphenyl-1,3,5,2-triazasilepane-4-thione

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 341.13819545
• Heavy Atom Count: 23
• Complexity: 421

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCN([Si](N(C1=S)C2=CC=CC=C2)(C)C3=CC=CC=C3)C

Technology Process of 1,2,5-Trimethyl-2,3-diphenyl-1,3,5,2-triazasilepane-4-thione

There total 2 articles about 1,2,5-Trimethyl-2,3-diphenyl-1,3,5,2-triazasilepane-4-thione 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:

dichloromethylphenylsilane (149-74-6) → 1,2,5-Trimethyl-2,3-diphenyl-[1,3,5,2]triazasilepane-4-thione (138767-59-6)

Guidance literature:

Multi-step reaction with 2 steps

1: diethyl ether; tetrahydrofuran / 24 h / Ambient temperature

2: CDCl₃ / 2 h / Ambient temperature

In tetrahydrofuran; diethyl ether; chloroform-d1;

DOI:10.1016/0022-328X(91)86160-R

Reference yield:

phenyl isothiocyanate (103-72-0) + 1,2,3-trimethyl-2-phenyl-1,3,2-diazasilacyclopentane (1012-34-6) → 1,2,5-Trimethyl-2,3-diphenyl-[1,3,5,2]triazasilepane-4-thione (138767-59-6)

Guidance literature:

In chloroform-d1; for 2h; Ambient temperature;

DOI:10.1016/0022-328X(91)86160-R

Reference yield: 30.0%

1,2,5-Trimethyl-2,3-diphenyl-[1,3,5,2]triazasilepane-4-thione (138767-59-6) → 1,3-dimethyl-2-phenylimino-1,3-diazolidine (25643-78-1)

Guidance literature:

at 70 ℃; for 2h;

DOI:10.1016/0022-328X(91)86160-R

upstream raw materials:

phenyl isothiocyanate

1,2,3-trimethyl-2-phenyl-1,3,2-diazasilacyclopentane

dichloromethylphenylsilane

Downstream raw materials:

1,3-dimethyl-2-phenylimino-1,3-diazolidine

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