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

Base Information

Chemical Name:3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole-5-thiol
CAS No.:14803-86-2
Molecular Formula:C11H13 N3 O3 S
Molecular Weight:267.309
Hs Code.:
NSC Number:305342
DSSTox Substance ID:DTXSID40933287
ChEMBL ID:CHEMBL1605787
Mol file:14803-86-2.mol

Synonyms:MLS-0286658.0001;NSC305342;MLS000708722;cid_888792;CHEMBL1605787;SCHEMBL12768570;BDBM46610;3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole-5-thiol;DTXSID40933287;HMS1691P04;HMS2620I21;STK080583;AKOS000550261;AKOS005392478;AKOS008963557;NSC-305342;SMR000289289;5-(3,4,5-Trimethoxyphenyl)-1H-1,2,4-triazole-3-thiol;5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

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

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 5 raw suppliers

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

Chemical Property:

Vapor Pressure:7.77E-06mmHg at 25°C
Boiling Point:375.4°C at 760 mmHg
Flash Point:180.9°C
Density:1.38g/cm³
XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:267.06776246
Heavy Atom Count:18
Complexity:336

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC(=CC(=C1OC)OC)C2=NC(=S)NN2

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

There total 9 articles about 3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole-5-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: 90.0%

: 7658-75-5
1-(3,4,5-trimethoxybenzoyl)thiosemicarbazide

: 14803-86-2
3-(3,4,5-trimethoxyphenyl)-4H-5-mercapto-1,2,4-triazole

Guidance literature:: With sodium hydroxide; In water; for 4h; Heating;

Reference yield:

: 1916-07-0
3,4,5-trimethoxybenzoic acid methyl ester

: 14803-86-2
3-(3,4,5-trimethoxyphenyl)-4H-5-mercapto-1,2,4-triazole

Guidance literature:: Multi-step reaction with 3 steps

1: hydrazine / water; methanol / Reflux

2: hydrogenchloride

3: sodium hydroxide

With hydrogenchloride; sodium hydroxide; hydrazine; In methanol; water;
DOI:10.1016/j.biopha.2017.07.139

Reference yield:

: 118-41-2
Eudesmic acid

: 14803-86-2
3-(3,4,5-trimethoxyphenyl)-4H-5-mercapto-1,2,4-triazole

Guidance literature:: Multi-step reaction with 4 steps

1: sulfuric acid / Reflux

2: hydrazine / water; methanol / Reflux

3: hydrogenchloride

4: sodium hydroxide

With hydrogenchloride; sulfuric acid; sodium hydroxide; hydrazine; In methanol; water;
DOI:10.1016/j.biopha.2017.07.139