6-Benzothiazolyl bromomethyl ketone

Base Information

Chemical Name:6-Benzothiazolyl bromomethyl ketone
CAS No.:19989-36-7
Molecular Formula:C₉H₆BrNOS
Molecular Weight:256.123
Hs Code.:
DSSTox Substance ID:DTXSID501291940

Synonyms:6-benzothiazolyl bromomethyl ketone;19989-36-7;SCHEMBL18305248;DTXSID501291940;1-(6-Benzothiazolyl)-2-bromoethanone

Suppliers and Price of 6-Benzothiazolyl bromomethyl ketone

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 6-Benzothiazolyl bromomethyl ketone

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:254.93535
Heavy Atom Count:13
Complexity:212

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC2=C(C=C1C(=O)CBr)SC=N2

Technology Process of 6-Benzothiazolyl bromomethyl ketone

There total 1 articles about 6-Benzothiazolyl bromomethyl ketone 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:

: 3622-35-3
benzothiazole-6-carboxylic acid

: 19989-36-7
1-(benzo[d]thiazol-6-yl)-2-bromoethan-1-one

Guidance literature:: Multi-step reaction with 3 steps

1.1: triethylamine; chloroformic acid ethyl ester / dichloromethane / 1 h / 10 °C

1.2: 1.5 h / 10 °C

2.1: tetrahydrofuran / 16.5 h / -10 - 20 °C / Inert atmosphere

3.1: phenyltrimethylammonium bromide dibromide / tetrahydrofuran / 16 h / 0 - 20 °C / Inert atmosphere

With phenyltrimethylammonium bromide dibromide; chloroformic acid ethyl ester; triethylamine; In tetrahydrofuran; dichloromethane;
DOI:10.1016/j.ejmech.2015.10.004