3-Ethoxy-5-chloromethylisothiazole

Base Information

Chemical Name:3-Ethoxy-5-chloromethylisothiazole
CAS No.:170953-78-3
Molecular Formula:C₆H₈ClNOS
Molecular Weight:177.655
Hs Code.:
DSSTox Substance ID:DTXSID10433724
Wikidata:Q82247934
Mol file:170953-78-3.mol

Synonyms:3-ETHOXY-5-CHLOROMETHYLISOTHIAZOLE;170953-78-3;5-(chloromethyl)-3-ethoxy-1,2-thiazole;DTXSID10433724;AKOS006327341;FT-0668093;J-010672

Suppliers and Price of 3-Ethoxy-5-chloromethylisothiazole

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

TRC
3-Ethoxy-5-chloromethylisothiazole
50mg
$ 305.00

Medical Isotopes, Inc.
3-Ethoxy-5-chloromethylisothiazole
50 mg
$ 875.00

American Custom Chemicals Corporation
3-ETHOXY-5-CHLOROMETHYLISOTHIAZOLE 95.00%
500MG
$ 1732.50

American Custom Chemicals Corporation
3-ETHOXY-5-CHLOROMETHYLISOTHIAZOLE 95.00%
50MG
$ 721.88

Total 3 raw suppliers

Chemical Property of 3-Ethoxy-5-chloromethylisothiazole

Chemical Property:

PSA：50.36000
LogP:2.28060
Storage Temp.:Refrigerator
Solubility.:Chloroform, Dichloromethane, Ether, Ethyl Acetate
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:177.0015127
Heavy Atom Count:10
Complexity:104

Purity/Quality:

97% ^*data from raw suppliers

3-Ethoxy-5-chloromethylisothiazole ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC1=NSC(=C1)CCl
Uses 3-Ethoxy-5-chloromethylisothiazole (cas# 170953-78-3) is a compound useful in organic synthesis.

Technology Process of 3-Ethoxy-5-chloromethylisothiazole

There total 2 articles about 3-Ethoxy-5-chloromethylisothiazole 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: 80.0%

: 170953-75-0
3-ethoxy-5-hydroxymethylisothiazole

: 170953-78-3
3-ethoxy-5-chloromethylisothiazole

Guidance literature:: With thionyl chloride; for 1h; Heating;
DOI:10.1002/jlcr.2580360909

Reference yield:

: 170953-74-9
methyl 3-ethoxyisothiazole-5-carboxylate

: 170953-78-3
3-ethoxy-5-chloromethylisothiazole

Guidance literature:: Multi-step reaction with 2 steps

1: 71 percent / NaBH₄ / methanol / 2.5 h / 25 °C

2: 80 percent / SOCl₂ / 1 h / Heating

With sodium tetrahydroborate; thionyl chloride; In methanol;
DOI:10.1002/jlcr.2580360909