Agn-PC-0ncpep

Base Information

Chemical Name:Agn-PC-0ncpep
CAS No.:20850-89-9
Molecular Formula:C₁₅H₁₀OS₂
Molecular Weight:270.376
Hs Code.:
NSC Number:303524
DSSTox Substance ID:DTXSID20448162
Nikkaji Number:J635.929I
Wikidata:Q82267123

Synonyms:20850-89-9;AGN-PC-0NCPEP;SCHEMBL3970877;DTXSID20448162;NSC303524;NSC-303524;2,5-Diphenyl-4-oxylato-1,3-dithiol-1-ium;1, 4-hydroxy-2,5-diphenyl-, hydroxide, inner salt

Suppliers and Price of Agn-PC-0ncpep

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 5 raw suppliers

Chemical Property of Agn-PC-0ncpep

Chemical Property:

XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:270.01730729
Heavy Atom Count:18
Complexity:395

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C2=S=C(SC2=O)C3=CC=CC=C3

Technology Process of Agn-PC-0ncpep

There total 6 articles about Agn-PC-0ncpep 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: 71.0%

: 75-15-0,12122-00-8
carbon disulfide

: 4870-65-9,31302-84-8
2-bromophenylacetic acid

: 108-86-1,52753-63-6
bromobenzene

: 20850-89-9
2,5-diphenyl-1,3-dithiolylium-4-olate

Guidance literature:: bromobenzene; With magnesium; In tetrahydrofuran; for 0.333333h;

carbon disulfide; In tetrahydrofuran; at 0 - 20 ℃;

2-bromophenylacetic acid; Further stages;
DOI:10.1002/anie.201708790

Reference yield: 26.0%

: 60027-35-2,1011402-09-7
4-phenyl-1,3,2-oxathiazolylium-5-olate

: 17835-44-8
4,5-diphenyl-3H-1,2-dithiol-3-one

: 20850-89-9
2,5-diphenyl-1,3-dithiolylium-4-olate

Guidance literature:: In xylene; at 140 ℃; for 3h;
DOI:10.1016/0040-4039(91)80617-F

Reference yield:

: 121-68-6
dithiobenzoic acid

: 20850-89-9
2,5-diphenyl-1,3-dithiolylium-4-olate

Guidance literature:: Multi-step reaction with 2 steps

1: sodium carbonate / water / 0 - 4 °C

2: acetic anhydride; triethylamine / 2 h / 0 - 10 °C

With acetic anhydride; sodium carbonate; triethylamine; In water;
DOI:10.1002/anie.201908052