4-[(2-Amino-4-chlorophenyl)sulfanyl]-1-(thiophen-2-YL)butan-1-one

Base Information

Chemical Name:4-[(2-Amino-4-chlorophenyl)sulfanyl]-1-(thiophen-2-YL)butan-1-one
CAS No.:87696-88-6
Molecular Formula:C14H14ClNOS2
Molecular Weight:311.85000
Hs Code.:
DSSTox Substance ID:DTXSID10520305
Wikidata:Q82384108

Synonyms:87696-88-6;DTXSID10520305;4-[(2-AMINO-4-CHLOROPHENYL)SULFANYL]-1-(THIOPHEN-2-YL)BUTAN-1-ONE

Suppliers and Price of 4-[(2-Amino-4-chlorophenyl)sulfanyl]-1-(thiophen-2-YL)butan-1-one

Supply Marketing:

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

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Chemical Property of 4-[(2-Amino-4-chlorophenyl)sulfanyl]-1-(thiophen-2-YL)butan-1-one

Chemical Property:

PSA：96.63000
LogP:5.32010
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:311.0205341
Heavy Atom Count:19
Complexity:303

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CSC(=C1)C(=O)CCCSC2=C(C=C(C=C2)Cl)N

Technology Process of 4-[(2-Amino-4-chlorophenyl)sulfanyl]-1-(thiophen-2-YL)butan-1-one

There total 1 articles about 4-[(2-Amino-4-chlorophenyl)sulfanyl]-1-(thiophen-2-YL)butan-1-one 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: 15.0%

: 76293-50-0
8-Chloro-3,4-dihydro-5-(2-thienyl)-2H-1,6-benzothiazocine

: 87696-88-6
4-(2-Amino-4-chloro-phenylsulfanyl)-1-thiophen-2-yl-butan-1-one

Guidance literature:: With mercury(II) diacetate; In acetic acid; at 70 ℃; for 24h;
DOI:10.1021/jo00175a024

Reference yield:

: 87696-88-6
4-(2-Amino-4-chloro-phenylsulfanyl)-1-thiophen-2-yl-butan-1-one

: 87697-16-3
5-chloro-N-methyl-2-<4-(2-thienyl)-3-butenylthio>aniline

Guidance literature:: Multi-step reaction with 4 steps

1: 99.5 percent / p-toluenesulfonic acid / toluene / Heating

2: 80 percent / lithium aluminium hydride / tetrahydrofuran / Heating

3: 1) sodium hydride / DMF

4: 36 percent / 5 N hydrochloric acid / diethyl ether

With hydrogenchloride; lithium aluminium tetrahydride; sodium hydride; toluene-4-sulfonic acid; In tetrahydrofuran; diethyl ether; toluene;
DOI:10.1021/jo00175a024