5-Bromoisothiazole

Base Information

Chemical Name:5-Bromoisothiazole
CAS No.:54390-97-5
Molecular Formula:C3H2BrNS
Molecular Weight:164.026
Hs Code.:2934999090
European Community (EC) Number:818-471-3
DSSTox Substance ID:DTXSID40505009
Wikidata:Q82359833
Mol file:54390-97-5.mol

Synonyms:5-Bromoisothiazole;54390-97-5;5-Bromo-1,2-thiazole;5-Bromo-isothiazole;Isothiazole, 5-bromo-;MFCD11110322;5-bromoisothi-azole;SCHEMBL3503301;DTXSID40505009;AKOS006309556;AT21099;SB37604;BS-35950;SY139079;CS-0157906;FT-0604341;A18883;EN300-103015;W-203049

Suppliers and Price of 5-Bromoisothiazole

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

Usbiological
5-Bromoisothiazole
250g
$ 460.00

TRC
5-Bromoisothiazole
250mg
$ 160.00

J&W Pharmlab
5-Bromo-isothiazole 97%
500mg
$ 249.00

J&W Pharmlab
5-Bromo-isothiazole 97%
100mg
$ 137.00

Crysdot
5-Bromoisothiazole 95+%
1g
$ 595.00

ChemBridge Corporation
5-bromoisothiazole 95%
5 g
$ 1375.00

Biosynth Carbosynth
5-Bromoisothiazole
50 mg
$ 137.50

Biosynth Carbosynth
5-Bromoisothiazole
25 mg
$ 87.50

Biosynth Carbosynth
5-Bromoisothiazole
100 mg
$ 220.00

American Custom Chemicals Corporation
5-BROMOISOTHIAZOLE 95.00%
10G
$ 4095.00

Total 14 raw suppliers

Chemical Property of 5-Bromoisothiazole

Chemical Property:

Vapor Pressure:77.191mmHg at 25°C
Refractive Index:1.605
Boiling Point:85.581 °C at 760 mmHg
Flash Point:5.56 °C
PSA：41.13000
Density:1.857 g/cm³
LogP:1.90560
Storage Temp.:under inert gas (nitrogen or Argon) at 2-8°C
XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:162.90913
Heavy Atom Count:6
Complexity:50.1

Purity/Quality:

97% ^*data from raw suppliers

5-Bromoisothiazole ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=C(SN=C1)Br
Uses 5-Bromoisothiazole, can be used in the synthesis of some 4-nitroisothiazoles, as potential antifungal agents. It is a derivative of Isothiazole (I917605), a versatile building block.

Technology Process of 5-Bromoisothiazole

There total 2 articles about 5-Bromoisothiazole 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: 21.0%

: 288-16-4
isothiazol

: 54390-97-5
5-bromo-1,2-thiazole

Guidance literature:: isothiazol; With n-butyllithium; In tetrahydrofuran; at -70 ℃; for 2h;

With bromine; In tetrahydrofuran; at -70 ℃; for 0.5h;

Reference yield:

: 54390-97-5
5-bromo-1,2-thiazole

Guidance literature:: Isothiazole 1. via isothiazol-5-yl Li, 2. bromine <-65 gradC>;
DOI:10.1039/jr9640000446

Reference yield: 58.8%

: (R)-6-(3-dimethylaminopyrrolidin-1-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-(4-(chlorodifluoromethoxy)phenyl)nicotinamide

: 54390-97-5
5-bromo-1,2-thiazole

: (R)-6-(3-dimethylaminopyrrolidin-1-yl)-5-(isothiazol-5-yl)-N-(4-(chlorodifluoromethoxy)phenyl)nicotinamide

Guidance literature:: With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; sodium carbonate; In 1,2-dimethoxyethane; water; at 100 ℃; for 0.5h; Inert atmosphere; Microwave irradiation;