5-benzyl-2,3-dihydro-1H-1,2,4-triazole-3-thione

Base Information

Chemical Name:5-benzyl-2,3-dihydro-1H-1,2,4-triazole-3-thione
CAS No.:28384-40-9
Molecular Formula:C9H9 N3 S
Molecular Weight:191.257
Hs Code.:2933990090
European Community (EC) Number:839-234-0
Nikkaji Number:J340.982A
Mol file:28384-40-9.mol

Synonyms:5-benzyl-2,3-dihydro-1H-1,2,4-triazole-3-thione;28384-40-9;5-benzyl-1,2-dihydro-1,2,4-triazole-3-thione;5-benzyl-2,4-dihydro-3H-1,2,4-triazole-3-thione;5-Benzyl-4H-[1,2,4]triazole-3-thiol;5-BENZYL-4H-(1,2,4)TRIAZOLE-3-THIOL;5-benzyl-4H-1,2,4-triazol-3-yl hydrosulfide;TimTec1_004333;SCHEMBL4198296;HMS1546E21;STK696451;AKOS000268447;AKOS001712962;SDCCGMLS-0065156.P001;FT-0606409;EN300-110629;AF-615/25002793;SR-01000514567;SR-01000514567-1;Z55982240

Suppliers and Price of 5-benzyl-2,3-dihydro-1H-1,2,4-triazole-3-thione

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

TRC
5-benzyl-2,3-dihydro-1H-1,2,4-triazole-3-thione
500mg
$ 310.00

American Custom Chemicals Corporation
3H-1,2,4-TRIAZOLE-3-THIONE, 1,2-DIHYDRO-5-(PHENYLMETHYL)- 95.00%
5MG
$ 495.72

Total 3 raw suppliers

Chemical Property of 5-benzyl-2,3-dihydro-1H-1,2,4-triazole-3-thione

Chemical Property:

Vapor Pressure:0.00125mmHg at 25°C
Melting Point:222 °C
Refractive Index:1.7
Boiling Point:298.6°C at 760 mmHg
PKA:9.22±0.20(Predicted)
Flash Point:134.4°C
PSA：80.37000
Density:1.33g/cm³
LogP:1.68420
XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:191.05171847
Heavy Atom Count:13
Complexity:231

Purity/Quality:

99% ^*data from raw suppliers

5-benzyl-2,3-dihydro-1H-1,2,4-triazole-3-thione ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)CC2=NC(=S)NN2

Technology Process of 5-benzyl-2,3-dihydro-1H-1,2,4-triazole-3-thione

There total 23 articles about 5-benzyl-2,3-dihydro-1H-1,2,4-triazole-3-thione 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%

: 29313-28-8
1-phenylacetyl-thiosemicarbazide

: 28384-40-9
1,2-dihydro-5-(phenylmethyl)-3H-1,2,4-triazole-3-thione

Guidance literature:: With sodium hydroxide; In methanol; Reflux;
DOI:10.2174/157018012799129882

Reference yield: 90.0%

: 58553-17-6
1-(4-chloro-benzoylamino)-4,4,6-trimethyl-3,4-dihydro-1H-pyrimidine-2-thione

: 28384-40-9
5-benzyl-1,2-dihydro-[1,2,4]triazole-3-thione

Guidance literature:: With sodium hydroxide; In ethanol; water; Heating;

Reference yield: 54.0%

: 109853-14-7
C₁₆H₁₆N₄OS₂

: 28384-40-9
5-benzyl-1,2-dihydro-[1,2,4]triazole-3-thione

: 103-71-9
phenyl isocyanate

Guidance literature:: N-benzyl-N,N,N-triethylammonium chloride; In sodium hydroxide; dichloromethane; for 12h; Ambient temperature;
DOI:10.1002/jhet.5570250405