6-Nitro-2-(4-nitrophenyl)-1,3-benzothiazole

Base Information

Chemical Name:6-Nitro-2-(4-nitrophenyl)-1,3-benzothiazole
CAS No.:53544-74-4
Molecular Formula:C13H7N3O4S
Molecular Weight:301.282
Hs Code.:
DSSTox Substance ID:DTXSID20549764
Nikkaji Number:J3.224.611G
Wikidata:Q82428902
Mol file:53544-74-4.mol

Synonyms:6-Nitro-2-(4-nitrophenyl)-1,3-benzothiazole;53544-74-4;6-nitro-2-(4-nitrophenyl)benzo[d]thiazole;SCHEMBL1996999;DTXSID20549764;VQXKCOXXFBUICA-UHFFFAOYSA-N

Suppliers and Price of 6-Nitro-2-(4-nitrophenyl)-1,3-benzothiazole

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of 6-Nitro-2-(4-nitrophenyl)-1,3-benzothiazole

Chemical Property:

XLogP3:3.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:301.01572689
Heavy Atom Count:21
Complexity:417

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Technology Process of 6-Nitro-2-(4-nitrophenyl)-1,3-benzothiazole

There total 7 articles about 6-Nitro-2-(4-nitrophenyl)-1,3-benzothiazole 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: 83.0%

: 22868-34-4
2-(4-nitrophenyl)benzothiazole

: 53544-74-4
2-(4'-nitrophenyl)-6-nitrobenzothiazole

Guidance literature:: With sulfuric acid; nitric acid; at 80 ℃; Inert atmosphere;

Reference yield: 67.1%

: 23451-98-1
2-amino-5-nitrobenzenethiol

: 555-16-8
4-nitrobenzaldehdye

: 53544-74-4
2-(4'-nitrophenyl)-6-nitrobenzothiazole

Guidance literature:: In pyridine; for 20h; Heating;
DOI:10.3390/11050325

Reference yield: 60.0%

: 2516-37-2
2-bromo-6-nitro-benzo[d]thiazole

: 171364-83-3
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)nitrobenzene

: 53544-74-4
2-(4'-nitrophenyl)-6-nitrobenzothiazole

Guidance literature:: 2-bromo-6-nitro-benzo[d]thiazole; 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)nitrobenzene; With potassium carbonate; In water; N,N-dimethyl-formamide; for 1h; Inert atmosphere;

With dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; In water; N,N-dimethyl-formamide; at 80 ℃; for 1h; Inert atmosphere;
DOI:10.1016/j.tet.2013.06.085