S-[2-Methyl-1-(methylsulfanyl)prop-1-en-1-yl] benzenecarbothioate

Base Information

Chemical Name:S-[2-Methyl-1-(methylsulfanyl)prop-1-en-1-yl] benzenecarbothioate
CAS No.:88472-04-2
Molecular Formula:C₁₂H₁₄OS₂
Molecular Weight:238.375
Hs Code.:
DSSTox Substance ID:DTXSID60524712

Synonyms:88472-04-2;DTXSID60524712;S-[2-Methyl-1-(methylsulfanyl)prop-1-en-1-yl] benzenecarbothioate

Suppliers and Price of S-[2-Methyl-1-(methylsulfanyl)prop-1-en-1-yl] benzenecarbothioate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of S-[2-Methyl-1-(methylsulfanyl)prop-1-en-1-yl] benzenecarbothioate

Chemical Property:

PSA：67.67000
LogP:4.17440
XLogP3:4.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:238.04860741
Heavy Atom Count:15
Complexity:248

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(=C(SC)SC(=O)C1=CC=CC=C1)C

Technology Process of S-[2-Methyl-1-(methylsulfanyl)prop-1-en-1-yl] benzenecarbothioate

There total 2 articles about S-[2-Methyl-1-(methylsulfanyl)prop-1-en-1-yl] benzenecarbothioate 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: 61.0%

: 98-88-4
benzoyl chloride

: Methyl dithioisobutyrate sodium salt

: 88472-04-2
1-Methylthio-2-methyl-1-propenyl thiobenzoate

Guidance literature:: In diethyl ether; for 4h; Ambient temperature;

Reference yield:

: 5874-02-2
methyl 2-methylpropanedithioate

: 88472-04-2
1-Methylthio-2-methyl-1-propenyl thiobenzoate

Guidance literature:: Multi-step reaction with 2 steps

1: 68 percent / Sodium salt of hexamethyldisilazane / diethyl ether / 0.67 h / Ambient temperature

2: 61 percent / diethyl ether / 4 h / Ambient temperature

With sodium hexamethyldisilazane; In diethyl ether;