5-(3,5-dimethoxyphenyl)-4-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol

Base Information

Chemical Name:5-(3,5-dimethoxyphenyl)-4-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol
CAS No.:5693-15-2
Molecular Formula:C18H19N3O2S
Molecular Weight:341.4274
Hs Code.:
DSSTox Substance ID:DTXSID10359192
Wikidata:Q82140273

Synonyms:5-(3,5-dimethoxyphenyl)-4-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol;5693-15-2;ZINC01246959;Oprea1_698880;DTXSID10359192;STK067252;STL148347;AKOS003827367;AKOS005748468;5-(3,5-dimethoxyphenyl)-4-(2-phenylethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

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

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 5-(3,5-dimethoxyphenyl)-4-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol

Chemical Property:

Vapor Pressure:1.3E-09mmHg at 25°C
Boiling Point:486.4°Cat760mmHg
Flash Point:248°C
Density:1.23g/cm³
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:341.11979803
Heavy Atom Count:24
Complexity:453

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC(=CC(=C1)C2=NNC(=S)N2CCC3=CC=CC=C3)OC

Technology Process of 5-(3,5-dimethoxyphenyl)-4-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol

There total 5 articles about 5-(3,5-dimethoxyphenyl)-4-(2-phenylethyl)-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:

: 3-Cyano-octadecanoic acid methyl ester

: 5693-15-2
α-pentadecylsuccinic acid

Guidance literature:: With barium dihydroxide; In ethanol; Heating;

Reference yield:

: 629-80-1
n-hexadecylaldehyde

: 5693-15-2
α-pentadecylsuccinic acid

Guidance literature:: Multi-step reaction with 4 steps

1: (i) Zn, (ii) (saponification)

2: HCl

3: (i) TsCl, Py, (ii) /BRN= 3587243/, DMSO

4: Ba(OH)2 / aq. ethanol / Heating

With hydrogenchloride; barium dihydroxide; In ethanol;

Reference yield:

: 17773-30-7
3-hydroxyoctadecanoic acid

: 5693-15-2
α-pentadecylsuccinic acid

Guidance literature:: Multi-step reaction with 3 steps

1: HCl

2: (i) TsCl, Py, (ii) /BRN= 3587243/, DMSO

3: Ba(OH)2 / aq. ethanol / Heating

With hydrogenchloride; barium dihydroxide; In ethanol;