Benzene, [bis(butylthio)methyl]-

Base Information

• Chemical Name: Benzene, [bis(butylthio)methyl]-
• CAS No.: 7315-50-6
• Molecular Formula: C15H24S2
• Molecular Weight: 268.488
• DSSTox Substance ID: DTXSID50455526
• Nikkaji Number: J565.907H
• Wikidata: Q82277584
• Mol file: 7315-50-6.mol

Synonyms:Benzene, [bis(butylthio)methyl]-;Bis(butylthio)methylbenzene;7315-50-6;DTXSID50455526

Chemical Property of Benzene, [bis(butylthio)methyl]-

Chemical Property:

• XLogP3: 5.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 268.13194311
• Heavy Atom Count: 17
• Complexity: 154

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCSC(C1=CC=CC=C1)SCCCC

Technology Process of Benzene, [bis(butylthio)methyl]-

There total 10 articles about Benzene, [bis(butylthio)methyl]- 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: 98.0%

n-butanethiol (109-79-5) + benzaldehyde (100-52-7) → α,α-bis(butylthio)toluene (7315-50-6)

Guidance literature:

With methanol; acetyl chloride; for 0.0833333h; Ambient temperature;

DOI:10.1080/00397919908085819

Reference yield: 87.0%

2-phenyl-1,3-dioxane (772-01-0) + n-butanethiol (109-79-5) → α,α-bis(butylthio)toluene (7315-50-6)

Guidance literature:

With tetrachlorosilane; In dichloromethane; at 20 ℃; for 0.5h;

DOI:10.1055/s-2000-6483

Reference yield: 87.0%

2-phenyl-1,3-dioxolane (936-51-6) + n-butanethiol (109-79-5) → α,α-bis(butylthio)toluene (7315-50-6)

Guidance literature:

With diethyl ether; lithium perchlorate; at 28 ℃; for 0.25h;

DOI:10.1021/jo00095a049

upstream raw materials:

n-butanethiol

benzaldehyde

4,4'-(phenylmethylene)bismorpholine

2-phenyl-1,3-dioxolane

Downstream raw materials:

dibutyl disulfide

benzaldehyde

bis-(butane-1-sulfonyl)-phenyl-methane

Refernces

• 1、 Vale, Joao R.,Rimpil?inen, Tatu,Siev?nen, Elina,Rissanen, Kari,Afonso, Carlos A. M.,Candeias, Nuno R.. "Pot-economy autooxidative condensation of 2-Aryl-2-lithio-1,3-dithianes". . p. 1948 - 1958. Retrieved 2018/02/23.
• 2、 Pandey, Lokesh Kumar,Pathak, Uma,Tank, Rekha,Mazumder, Avik. "Silica-PCl5: A novel heterogenous catalyst for simple and efficient chemoselective protection of carbonyl compounds". experimental part. p. 167 - 171. Retrieved 2010/07/05.