5-[(2-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol

Base Information

Chemical Name:5-[(2-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol
CAS No.:76111-25-6
Molecular Formula:C16H15N3OS
Molecular Weight:297.37500
Hs Code.:
DSSTox Substance ID:DTXSID901322761
ChEMBL ID:CHEMBL1569753
Mol file:76111-25-6.mol

Synonyms:5-[(2-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol;76111-25-6;3-[(2-methylphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione;Oprea1_678605;MLS000856263;CHEMBL1569753;DTXSID901322761;HMS2676M05;CCG-24241;MFCD00299245;STK281833;STK846669;AKOS000283249;AKOS005627047;UPCMLD0ENAT5221672:001;LS-08397;SMR000279208;BB 0217510;EU-0049740;EN300-09002;Z56276690;5-[(2-methylphenoxy)methyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

Suppliers and Price of 5-[(2-methylphenoxy)methyl]-4-phenyl-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:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Matrix Scientific
5-[(2-Methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol
5g
$ 460.00

Matrix Scientific
5-[(2-Methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol
1g
$ 150.00

Matrix Scientific
5-[(2-Methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol
0.500g
$ 120.00

American Custom Chemicals Corporation
5-[(2-METHYLPHENOXY)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL 95.00%
1G
$ 692.46

Total 3 raw suppliers

Chemical Property of 5-[(2-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol

Chemical Property:

PSA：78.74000
LogP:3.44340
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:297.09358328
Heavy Atom Count:21
Complexity:406

Purity/Quality:

99% ^*data from raw suppliers

5-[(2-Methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=CC=C1OCC2=NNC(=S)N2C3=CC=CC=C3

Technology Process of 5-[(2-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol

There total 5 articles about 5-[(2-methylphenoxy)methyl]-4-phenyl-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:

: 36304-37-7
o-tolyloxyacetic acid hydrazide

: 76111-25-6
4-Phenyl-5-o-tolyloxymethyl-4H-[1,2,4]triazole-3-thiol

Guidance literature:: Multi-step reaction with 2 steps

1: ethanol / Heating

2: aq. NaOH / 3 h / Heating

With sodium hydroxide; In ethanol;
DOI:10.1016/S0223-5234(01)01252-1

Reference yield:

: 103-72-0
phenyl isothiocyanate

: 76111-25-6
4-Phenyl-5-o-tolyloxymethyl-4H-[1,2,4]triazole-3-thiol

Guidance literature:: Multi-step reaction with 2 steps

1: ethanol / Heating

2: aq. NaOH / 3 h / Heating

With sodium hydroxide; In ethanol;
DOI:10.1016/S0223-5234(01)01252-1