2-(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)phenol

Base Information

Chemical Name:2-(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)phenol
CAS No.:63224-33-9
Molecular Formula:C9H9N3OS
Molecular Weight:207.256
Hs Code.:2933990090
Nikkaji Number:J24.852E
Mol file:63224-33-9.mol

Synonyms:3-(2-hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione;triazolinethione HMT

Suppliers and Price of 2-(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)phenol

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

Crysdot
2-(5-Mercapto-4-methyl-4H-1,2,4-triazol-3-yl)phenol 97%
5g
$ 527.00

Total 5 raw suppliers

Chemical Property of 2-(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)phenol

Chemical Property:

Vapor Pressure:0.000405mmHg at 25°C
Boiling Point:316.6°C at 760 mmHg
Flash Point:145.3°C
PSA：89.48000
Density:1.43g/cm³
LogP:0.16380
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:207.04663309
Heavy Atom Count:14
Complexity:279

Purity/Quality:

97% ^*data from raw suppliers

2-(5-Mercapto-4-methyl-4H-1,2,4-triazol-3-yl)phenol 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C(=NNC1=S)C2=CC=CC=C2O

Technology Process of 2-(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)phenol

There total 4 articles about 2-(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)phenol 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:

: 936-02-7
2-Hydroxybenzoylhydrazine

: 556-61-6
methyl thioisocyanate

: 63224-33-9
5-(2-hydroxy-phenyl)-4-methyl-2,4-dihydro-[1,2,4]triazole-3-thione

Guidance literature:: 2-Hydroxybenzoylhydrazine; methyl thioisocyanate; In ethanol; at 80 ℃; for 3h;

With sodium hydroxide; at 100 ℃; for 4h;
DOI:10.3390/molecules26226948

Reference yield:

: 936-02-7
2-Hydroxybenzoylhydrazine

: 63224-33-9
5-(2-hydroxy-phenyl)-4-methyl-2,4-dihydro-[1,2,4]triazole-3-thione

Guidance literature:: Multi-step reaction with 2 steps

1: ethanol / 0.17 h / Reflux

2: sodium hydroxide / 12 h / Reflux

With sodium hydroxide; In ethanol;
DOI:10.33224/rrch.2019.64.1.10