4-[5-(1,3-Benzothiazol-2-yl)thiophen-2-yl]benzoic acid

Base Information

Chemical Name:4-[5-(1,3-Benzothiazol-2-yl)thiophen-2-yl]benzoic acid
CAS No.:174623-09-7
Molecular Formula:C18H11NO2S2
Molecular Weight:337.423
Hs Code.:
DSSTox Substance ID:DTXSID20569886
Wikidata:Q82457138

Synonyms:174623-09-7;4-[5-(1,3-Benzothiazol-2-yl)thiophen-2-yl]benzoic acid;DTXSID20569886;2-(p-carboxyphenyl)-5-(2-benzothiazolyl)-thiophene

Suppliers and Price of 4-[5-(1,3-Benzothiazol-2-yl)thiophen-2-yl]benzoic acid

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
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price

Total 1 raw suppliers

Chemical Property of 4-[5-(1,3-Benzothiazol-2-yl)thiophen-2-yl]benzoic acid

Chemical Property:

XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:337.02312094
Heavy Atom Count:23
Complexity:439

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C2C(=C1)N=C(S2)C3=CC=C(S3)C4=CC=C(C=C4)C(=O)O

Technology Process of 4-[5-(1,3-Benzothiazol-2-yl)thiophen-2-yl]benzoic acid

There total 2 articles about 4-[5-(1,3-Benzothiazol-2-yl)thiophen-2-yl]benzoic acid 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:

: 98-03-3
thiophene-2-carbaldehyde

: 174623-09-7
2-(5-p-Carboxyphenyl-2-thienyl)-benzothiazole

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) NaNO₂, aq. HCl

2: 1.) pyridine, 2.) FeCl₃ / 1.) reflux, 0.5 h, 2.) EtOH

With pyridine; hydrogenchloride; iron(III) chloride; sodium nitrite;
DOI:10.1007/BF00807067

Reference yield:

: 150-13-0,159246-81-8,8014-65-1
4-amino-benzoic acid

: 174623-09-7
2-(5-p-Carboxyphenyl-2-thienyl)-benzothiazole

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) NaNO₂, aq. HCl

2: 1.) pyridine, 2.) FeCl₃ / 1.) reflux, 0.5 h, 2.) EtOH

With pyridine; hydrogenchloride; iron(III) chloride; sodium nitrite;
DOI:10.1007/BF00807067