5-(4-ethoxybenzyl)-4-methyl-4H-1,2,4-triazole-3-thiol

Base Information

Chemical Name:5-(4-ethoxybenzyl)-4-methyl-4H-1,2,4-triazole-3-thiol
CAS No.:69198-27-2
Molecular Formula:C₁₂H₁₅N₃OS
Molecular Weight:249.337
Hs Code.:
DSSTox Substance ID:DTXSID201144922

Synonyms:69198-27-2;DTXSID201144922;STK830785;AKOS000510230;5-(4-ethoxybenzyl)-4-methyl-4H-1,2,4-triazole-3-thiol;5-[(4-Ethoxyphenyl)methyl]-2,4-dihydro-4-methyl-3H-1,2,4-triazole-3-thione

Suppliers and Price of 5-(4-ethoxybenzyl)-4-methyl-4H-1,2,4-triazole-3-thiol

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

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Chemical Property of 5-(4-ethoxybenzyl)-4-methyl-4H-1,2,4-triazole-3-thiol

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:249.09358328
Heavy Atom Count:17
Complexity:311

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC1=CC=C(C=C1)CC2=NNC(=S)N2C

Technology Process of 5-(4-ethoxybenzyl)-4-methyl-4H-1,2,4-triazole-3-thiol

There total 1 articles about 5-(4-ethoxybenzyl)-4-methyl-4H-1,2,4-triazole-3-thiol 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:

: 69198-27-2
5-(4-ethoxy-benzyl)-4-methyl-2,4-dihydro-[1,2,4]triazole-3-thione

Guidance literature:: 1-<4-Aethoxy-phenylacetyl>-4-methyl-thiosemicarbazid, wss. KOH;
DOI:10.1007/BF00772640

Reference yield: 97.0%

: 69198-27-2
5-(4-ethoxy-benzyl)-4-methyl-2,4-dihydro-[1,2,4]triazole-3-thione

: 2-{[4-methyl-5-(4-ethoxybenzyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid

Guidance literature:: 5-(4-ethoxy-benzyl)-4-methyl-2,4-dihydro-[1,2,4]triazole-3-thione; With potassium hydroxide; In ethanol; Reflux;

2-halidoacetic acid; In ethanol; Heating;
DOI:10.1134/S1070363217050140

Reference yield: 94.0%

: 69198-27-2
5-(4-ethoxy-benzyl)-4-methyl-2,4-dihydro-[1,2,4]triazole-3-thione

: 500114-00-1
3-[(3-bromo-4-methoxybenzyl)sulfanyl]-4-methyl-5-(4-ethoxybenzyl)-4H-1,2,4-triazole

Guidance literature:: 5-(4-ethoxy-benzyl)-4-methyl-2,4-dihydro-[1,2,4]triazole-3-thione; With potassium hydroxide; In ethanol; Reflux;

2-bromo-4-(halidomethyl)-1-methoxybenzene; In ethanol; Heating;
DOI:10.1134/S1070363217050140