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

Base Information

Chemical Name:4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazole-3-thiol
CAS No.:63279-75-4
Molecular Formula:C15H19N3OS
Molecular Weight:283.354
Hs Code.:2933990090
DSSTox Substance ID:DTXSID90356321
Wikidata:Q82135590
Mol file:63279-75-4.mol

Synonyms:4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazole-3-thiol;63279-75-4;4-(4-methoxyphenyl)-3-phenyl-1H-1,2,4-triazole-5-thione;4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl hydrosulfide;Oprea1_251125;AA-504/33314057;SCHEMBL12110672;DTXSID90356321;STK319351;STK321134;AKOS000268634;AKOS005434005;UPCMLD0ENAT0519-5319:001;CS-0116973;EN300-07018;SR-01000296434;SR-01000296434-1;Z56940950;4-(4-Methoxyphenyl)-5-phenyl-4H-[1,2,4]triazole-3-thiol;4-(4-methoxyphenyl)-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

Suppliers and Price of 4-(4-methoxyphenyl)-5-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

American Custom Chemicals Corporation
4-(4-METHOXYPHENYL)-5-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL 95.00%
5G
$ 1295.03

American Custom Chemicals Corporation
4-(4-METHOXYPHENYL)-5-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL 95.00%
2.5G
$ 1065.66

American Custom Chemicals Corporation
4-(4-METHOXYPHENYL)-5-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL 95.00%
1G
$ 765.23

AK Scientific
4-(4-Methoxyphenyl)-5-phenyl-4H-1,2,4-triazole-3-thiol
1g
$ 387.00

AK Scientific
4-(4-Methoxyphenyl)-5-phenyl-4H-1,2,4-triazole-3-thiol
250mg
$ 203.00

Total 3 raw suppliers

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

Chemical Property:

Vapor Pressure:2.91E-07mmHg at 25°C
Melting Point:232 °C
Boiling Point:420°Cat760mmHg
PKA:5.35±0.20(Predicted)
Flash Point:207.8°C
PSA：78.74000
Density:1.27g/cm³
LogP:3.23160
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:283.07793322
Heavy Atom Count:20
Complexity:385

Purity/Quality:

NLT 98% ^*data from raw suppliers

4-(4-METHOXYPHENYL)-5-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=CC=C3

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

There total 4 articles about 4-(4-methoxyphenyl)-5-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: 86.0%

: 38240-77-6
1-benzoyl-4-(4-methoxy-phenyl)-thiosemicarbazide

: 63279-75-4
4?(4?methoxyphenyl)?5?phenyl?4H?1,2,4?triazole?3?thiol

Guidance literature:: With sodium hydroxide; In water; for 1h; Reflux;
DOI:10.1007/s11030-020-10050-0

Reference yield:

: 613-94-5
benzoic acid hydrazide

: 63279-75-4
4?(4?methoxyphenyl)?5?phenyl?4H?1,2,4?triazole?3?thiol

Guidance literature:: Multi-step reaction with 2 steps

1: ethanol / Reflux

2: sodium hydroxide / water / Reflux

With sodium hydroxide; In ethanol; water;
DOI:10.1007/s11224-019-01453-3

Reference yield:

: 93-58-3,5705-52-2,80226-58-0
benzoic acid methyl ester

: 63279-75-4
4?(4?methoxyphenyl)?5?phenyl?4H?1,2,4?triazole?3?thiol

Guidance literature:: Multi-step reaction with 3 steps

1: hydrazine hydrate / ethanol / Reflux

2: ethanol / Reflux

3: sodium hydroxide / water / Reflux

With hydrazine hydrate; sodium hydroxide; In ethanol; water;
DOI:10.1007/s11224-019-01453-3