1-Chloro-4-[(3-methoxybuta-1,3-dien-2-yl)sulfanyl]benzene

Base Information

Chemical Name:1-Chloro-4-[(3-methoxybuta-1,3-dien-2-yl)sulfanyl]benzene
CAS No.:74851-97-1
Molecular Formula:C11H11ClOS
Molecular Weight:226.727
Hs Code.:
DSSTox Substance ID:DTXSID80503226
Wikidata:Q82356878

Synonyms:74851-97-1;DTXSID80503226;1-Chloro-4-[(3-methoxybuta-1,3-dien-2-yl)sulfanyl]benzene

Suppliers and Price of 1-Chloro-4-[(3-methoxybuta-1,3-dien-2-yl)sulfanyl]benzene

Supply Marketing:

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

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Chemical Property of 1-Chloro-4-[(3-methoxybuta-1,3-dien-2-yl)sulfanyl]benzene

Chemical Property:

XLogP3:4.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:226.0219138
Heavy Atom Count:14
Complexity:219

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=C)C(=C)SC1=CC=C(C=C1)Cl

Technology Process of 1-Chloro-4-[(3-methoxybuta-1,3-dien-2-yl)sulfanyl]benzene

There total 2 articles about 1-Chloro-4-[(3-methoxybuta-1,3-dien-2-yl)sulfanyl]benzene 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: 94.0%

: 74851-94-8
1-methoxy-2-(4'-chlorophenylthio)cyclobutene

: 74851-97-1
2-(4'-chlorophenylthio)-3-methoxybuta-1,3-diene

Guidance literature:: at 350 ℃; under 1 Torr;
DOI:10.1021/ja00530a040

Reference yield:

: 74851-90-4
2-(4-chlorophenylsulfanyl)cyclobutanone

: 74851-97-1
2-(4'-chlorophenylthio)-3-methoxybuta-1,3-diene

Guidance literature:: Multi-step reaction with 2 steps

1: 57 percent / potassium hydride / dimethylformamide / 2 h / -10 °C

2: 94 percent / 350 °C / 1 Torr

With potassium hydride; In N,N-dimethyl-formamide;
DOI:10.1021/ja00530a040

Reference yield:

: 78-94-4,25038-87-3
methyl vinyl ketone

: 74851-97-1
2-(4'-chlorophenylthio)-3-methoxybuta-1,3-diene

: 74852-11-2
4-acetyl-2-(4'-chlorophenylthio)-1-methoxy-1-cyclohexene

: 74852-09-8
4-acetyl-1-(4'-chlorophenylthio)-2-methoxy-1-cyclohexene

Guidance literature:: With 2,6-di-tert-butyl-4-methyl-phenol; magnesium bromide; In neat (no solvent); for 12h; Yield given. Yields of byproduct given. Title compound not separated from byproducts; Ambient temperature;
DOI:10.1021/ja00530a041