2-(1,2,3-Thiadiazol-4-yl)phenyl isocyanatosulfonate

Base Information

• Chemical Name: 2-(1,2,3-Thiadiazol-4-yl)phenyl isocyanatosulfonate
• CAS No.: 89406-33-7
• Molecular Formula: C9H5N3O4S2
• Molecular Weight: 283.288
• DSSTox Substance ID: DTXSID80606761
• Mol file: 89406-33-7.mol

Synonyms:89406-33-7;2-(1,2,3-Thiadiazol-4-yl)phenyl isocyanatosulfonate;SCHEMBL10984172;DTXSID80606761;FZADSUFXGVRKPH-UHFFFAOYSA-N;2-(1,2,3-Thiadiazol-4-yl)phenyl sulfurisocyanatidate

Chemical Property of 2-(1,2,3-Thiadiazol-4-yl)phenyl isocyanatosulfonate

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 282.97214800
• Heavy Atom Count: 18
• Complexity: 430

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C2=CSN=N2)OS(=O)(=O)N=C=O

Technology Process of 2-(1,2,3-Thiadiazol-4-yl)phenyl isocyanatosulfonate

There total 1 articles about 2-(1,2,3-Thiadiazol-4-yl)phenyl isocyanatosulfonate 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:

4-(2'-hydroxyphenyl)-1,2,3-thiadiazole (59834-06-9) → 2-(1,2,3-Thiadiazol-4-yl)phenyl isocyanatosulfonate (89406-33-7)

Guidance literature:

In toluene;

Reference yield:

2-(1,2,3-Thiadiazol-4-yl)phenyl isocyanatosulfonate (89406-33-7) → 2-(1,2,3-Thiadiazol-4-yl)phenyl N-[(4,6-dimethoxypyrimidin-2-yl)aminocarbonyl]sulfamate

Guidance literature:

In tetrahydrofuran;

upstream raw materials:

4-(2'-hydroxyphenyl)-1,2,3-thiadiazole