5-mercapto-4-phenyl-4H-1,2,4-triazol-3-ol

Base Information

Chemical Name:5-mercapto-4-phenyl-4H-1,2,4-triazol-3-ol
CAS No.:27106-12-3
Deprecated CAS:39186-13-5
Molecular Formula:C8H7 N3 O S
Molecular Weight:193.229
Hs Code.:2933998090
European Community (EC) Number:683-783-7
NSC Number:93431
DSSTox Substance ID:DTXSID90371473
Nikkaji Number:J2.417.808K
Mol file:27106-12-3.mol

Synonyms:27106-12-3;5-mercapto-4-phenyl-4H-1,2,4-triazol-3-ol;5-mercapto-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one;4-phenyl-5-sulfanylidene-1,2,4-triazolidin-3-one;4-Phenyl-5-sulfanyl-4H-1,2,4-triazol-3-ol;NSC93431;NCIOpen2_001319;SCHEMBL7806028;SCHEMBL8178332;DTXSID90371473;RAOXPTJDYMBTGU-UHFFFAOYSA-N;CBA10612;MFCD08582841;NSC-93431;STK272298;AKOS003395076;AKOS003725942;LS-08462;4-Phenyl-5-thioxo-1,2,4-triazolidin-3-one;5-Hydroxy-4-phenyl-1,2,4-triazole-3-thiol;3-Hydroxy-5-mercapto-4-phenyl-1,2,4-triazole;EN300-6477574;3-Mercapto-4-phenyl-1H-1,2,4-triazole-5(4H)-one;5-MERCAPTO-4-PHENYL-4H-(1,2,4)TRIAZOL-3-OL;Z3223353826;4-phenyl-3-sulfanyl-4,5-dihydro-1H-1,2,4-triazol-5-one;4-phenyl-5-sulfanyl-2,4-dihydro-3H-1,2,4-triazol-3-one

Suppliers and Price of 5-mercapto-4-phenyl-4H-1,2,4-triazol-3-ol

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

Sigma-Aldrich
5-MERCAPTO-4-PHENYL-4H-(1,2,4)TRIAZOL-3-OL Aldrich
10mg
$ 115.00

Crysdot
5-Mercapto-4-phenyl-4H-1,2,4-triazol-3-ol 95+%
5g
$ 752.00

Atlantic Research Chemicals
5-Hydroxy-4-phenyl-1,2,4-triazole-3-thiol 95%
Price $/1gm:
$ 412.87

American Custom Chemicals Corporation
5-HYDROXY-4-PHENYL-1,2,4-TRIAZOLE-3-THIOL 95.00%
10MG
$ 703.40

AK Scientific
5-Mercapto-4-phenyl-4H-1,2,4-triazol-3-ol
2.5g
$ 864.00

Total 8 raw suppliers

Chemical Property of 5-mercapto-4-phenyl-4H-1,2,4-triazol-3-ol

Chemical Property:

Vapor Pressure:2.95E-08mmHg at 25°C
Melting Point:197 °C
Boiling Point:437.3°Cat760mmHg
PKA:8.06±0.20(Predicted)
Flash Point:218.3°C
PSA：85.67000
Density:1.5g/cm³
LogP:1.22320
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:193.03098303
Heavy Atom Count:13
Complexity:238

Purity/Quality:

NLT 98% ^*data from raw suppliers

5-MERCAPTO-4-PHENYL-4H-(1,2,4)TRIAZOL-3-OL Aldrich ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 5-mercapto-4-phenyl-4H-1,2,4-triazol-3-ol

There total 13 articles about 5-mercapto-4-phenyl-4H-1,2,4-triazol-3-ol 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: 73.5%