AY9Hdq4A2H

Base Information

Chemical Name:AY9Hdq4A2H
CAS No.:850007-13-5
Molecular Formula:C₁₄H₂₃NO₂S
Molecular Weight:269.408
Hs Code.:
UNII:AY9HDQ4A2H
DSSTox Substance ID:DTXSID001029306
Wikipedia:4C-T-2
Wikidata:Q4638869
ChEMBL ID:CHEMBL372719

Synonyms:4C-T-2;AY9HDQ4A2H;UNII-AY9HDQ4A2H;CHEMBL372719;850007-13-5;alpha-Ethyl-4-(ethylthio)-2,5-dimethoxybenzeneethanamine;Benzeneethanamine, alpha-ethyl-4-(ethylthio)-2,5-dimethoxy-;SCHEMBL24765230;DTXSID001029306;BDBM50164331;Q4638869;1-(4-Ethylsulfanyl-2,5-dimethoxy-benzyl)-propylamine;1-[4-(Ethylsulfanyl)-2,5-dimethoxyphenyl]-2-butanamine;.ALPHA.-ETHYL-4-(ETHYLTHIO)-2,5-DIMETHOXYBENZENEETHANAMINE;BENZENEETHANAMINE, .ALPHA.-ETHYL-4-(ETHYLTHIO)-2,5-DIMETHOXY-

Suppliers and Price of AY9Hdq4A2H

Supply Marketing:

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

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Chemical Property of AY9Hdq4A2H

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:269.14495015
Heavy Atom Count:18
Complexity:228

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCC(CC1=CC(=C(C=C1OC)SCC)OC)N

Technology Process of AY9Hdq4A2H

There total 3 articles about AY9Hdq4A2H 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:

: 849919-72-8
1-(2,5-dimethoxy-4-ethylthiophenyl)-2-nitro-1-butene

: 850007-13-5
1-(4-ethylsulfanyl-2,5-dimethoxy-benzyl)-propylamine

Guidance literature:: With lithium aluminium tetrahydride; In tetrahydrofuran; for 36h; Heating;
DOI:10.1021/jm0493109

Reference yield:

: 24920-39-6
2-ethylsulfanyl-1,4-dimethoxybenzene

: 850007-13-5
1-(4-ethylsulfanyl-2,5-dimethoxy-benzyl)-propylamine

Guidance literature:: Multi-step reaction with 3 steps

1.1: POCl₃ / 40 - 50 °C

1.2: 88 percent / 0.25 h / 70 °C

2.1: 54 percent / N,N-dimethylethylenediamine / toluene / 48 h / Heating

3.1: LiAlH₄ / tetrahydrofuran / 36 h / Heating

With lithium aluminium tetrahydride; N,N`-dimethylethylenediamine; trichlorophosphate; In tetrahydrofuran; toluene; 1.1: Vilsmeier reaction;
DOI:10.1021/jm0493109

Reference yield:

: 132184-34-0
4-ethylsulfanyl-2,5-dimethoxybenzaldehyde

: 850007-13-5
1-(4-ethylsulfanyl-2,5-dimethoxy-benzyl)-propylamine

Guidance literature:: Multi-step reaction with 2 steps

1: 54 percent / N,N-dimethylethylenediamine / toluene / 48 h / Heating

2: LiAlH₄ / tetrahydrofuran / 36 h / Heating

With lithium aluminium tetrahydride; N,N`-dimethylethylenediamine; In tetrahydrofuran; toluene;
DOI:10.1021/jm0493109