1,2-Benzisoselenazol-3(2H)-one, 2-(3-hydroxyphenyl)-

Base Information

Chemical Name:1,2-Benzisoselenazol-3(2H)-one, 2-(3-hydroxyphenyl)-
CAS No.:81744-02-7
Molecular Formula:C13H9NO2Se
Molecular Weight:290.18
Hs Code.:
DSSTox Substance ID:DTXSID50231322
Nikkaji Number:J2.496.649F
Wikidata:Q83112212
Mol file:81744-02-7.mol

Synonyms:1,2-Benzisoselenazol-3(2H)-one, 2-(3-hydroxyphenyl)-;81744-02-7;2-(3-Hydroxyphenyl)-1,2-benzisoselenazol-3(2H)-one;SCHEMBL10604411;DTXSID50231322;LS-33525;2-(3-Hydroxyphenyl)-2-aza-1-selenaindan-3-one

Suppliers and Price of 1,2-Benzisoselenazol-3(2H)-one, 2-(3-hydroxyphenyl)-

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

Total 4 raw suppliers

Chemical Property of 1,2-Benzisoselenazol-3(2H)-one, 2-(3-hydroxyphenyl)-

Chemical Property:

Vapor Pressure:3.99E-10mmHg at 25°C
Boiling Point:487.4°C at 760 mmHg
PKA:9.48±0.10(Predicted)
Flash Point:248.6°C
PSA：42.23000
LogP:1.75330
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:290.97985
Heavy Atom Count:17
Complexity:310

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C2C(=C1)C(=O)N([Se]2)C3=CC(=CC=C3)O

Technology Process of 1,2-Benzisoselenazol-3(2H)-one, 2-(3-hydroxyphenyl)-

There total 5 articles about 1,2-Benzisoselenazol-3(2H)-one, 2-(3-hydroxyphenyl)- 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: 76.0%

: 1441-85-6
2-(chloroseleno)benzoyl chloride

: 591-27-5
m-Hydroxyaniline

: 81744-02-7
2-(3-hydroxyphenyl)-1.2-benzisoselenazol-3(2H)-one

Guidance literature:: In acetonitrile; at 20 ℃; for 2h;
DOI:10.1002/chem.200601584

Reference yield: 24.0%

: 2-iodo-N-(3-hydroxyphenyl)benzamide

: 81744-02-7
2-(3-hydroxyphenyl)-1.2-benzisoselenazol-3(2H)-one

Guidance literature:: With copper(l) iodide; 1,10-Phenanthroline; potassium selenocyanate; caesium carbonate; In N,N-dimethyl-formamide; at 100 ℃; for 1h; Inert atmosphere;
DOI:10.1016/j.bioorg.2021.105455