1-(3-Pyridinylsulfonyl)-1H-benzotriazole

Base Information

Chemical Name:1-(3-Pyridinylsulfonyl)-1H-benzotriazole
CAS No.:678173-43-8
Molecular Formula:C11H8N4O2S
Molecular Weight:260.27
Hs Code.:
DSSTox Substance ID:DTXSID30395315
Nikkaji Number:J2.266.644D
Wikidata:Q82195329
Mol file:678173-43-8.mol

Synonyms:1-(3-Pyridinylsulfonyl)-1H-benzotriazole;678173-43-8;1-pyridin-3-ylsulfonylbenzotriazole;1-(Pyridin-3-ylsulfonyl)-1H-benzo[d][1,2,3]triazole;SCHEMBL4339723;DTXSID30395315;1-(3-Pyridylsulfonyl)-1H-benzotriazole;1-(3-Pyridinylsulfonyl)-1H-benzotriazole, 95%

Suppliers and Price of 1-(3-Pyridinylsulfonyl)-1H-benzotriazole

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
1-(3-Pyridinylsulfonyl)-1H-benzotriazole 95%
250mg
$ 98.80

American Custom Chemicals Corporation
1-(3-PYRIDINYLSULFONYL)-1H-BENZOTRIAZOLE 95.00%
250MG
$ 638.27

Total 4 raw suppliers

Chemical Property of 1-(3-Pyridinylsulfonyl)-1H-benzotriazole

Chemical Property:

Vapor Pressure:4.68E-10mmHg at 25°C
Melting Point:136-140 °C
Refractive Index:1.741
Boiling Point:498.1°C at 760 mmHg
Flash Point:255°C
PSA：86.12000
Density:1.53g/cm³
LogP:2.14410
XLogP3:1.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:260.03679668
Heavy Atom Count:18
Complexity:394

Purity/Quality:

98%,99%, ^*data from raw suppliers

1-(3-Pyridinylsulfonyl)-1H-benzotriazole 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xn
Statements: 22-36/37/38
Safety Statements: 26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC=C2C(=C1)N=NN2S(=O)(=O)C3=CN=CC=C3

Technology Process of 1-(3-Pyridinylsulfonyl)-1H-benzotriazole

There total 1 articles about 1-(3-Pyridinylsulfonyl)-1H-benzotriazole 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: 50.0%

: 60573-68-4
3-pyridyllithium

: 21050-95-3
N-chlorobenzotriazole

: 678173-43-8
1-(3-pyridylsulfonyl)-1H-1,2,3-benzotriazole

Guidance literature:: With sulfur dioxide; triethylamine;
DOI:10.1055/s-2008-1072568

Reference yield: 100.0%

: 110-89-4
piperidine

: 678173-43-8
1-(3-pyridylsulfonyl)-1H-1,2,3-benzotriazole

: 26103-49-1
3-(piperidin-1-ylsulfonyl)pyridine

Guidance literature:: In N,N-dimethyl-formamide; at 80 ℃; for 48h;
DOI:10.1021/jo035515y

Reference yield: 73.0%

: 140-29-4
phenylacetonitrile

: 678173-43-8
1-(3-pyridylsulfonyl)-1H-1,2,3-benzotriazole

: 2-phenyl-2-(3-pyridinylsulfonyl)propanenitrile

Guidance literature:: phenylacetonitrile; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 1h;

1-(3-pyridylsulfonyl)-1H-1,2,3-benzotriazole; In tetrahydrofuran; hexane; at -78 - 20 ℃;
DOI:10.1021/jo051157i