4-(Ethoxycarbonyl)isothiazole-5-carboxylic acid

Base Information

Chemical Name:4-(Ethoxycarbonyl)isothiazole-5-carboxylic acid
CAS No.:98279-60-8
Molecular Formula:C₇H₇NO₄S
Molecular Weight:201.203
Hs Code.:2934999090
DSSTox Substance ID:DTXSID70696914
Wikidata:Q82626677
Mol file:98279-60-8.mol

Synonyms:98279-60-8;4-(ETHOXYCARBONYL)ISOTHIAZOLE-5-CARBOXYLIC ACID;4-ethoxycarbonyl-1,2-thiazole-5-carboxylic acid;DTXSID70696914;4-ethoxycarbonylisothiazole-5-carboxylic acid;4,5-Isothiazoledicarboxylic acid 4-ethyl ester;A845834;4-(ETHOXYCARBONYL)-1,2-THIAZOLE-5-CARBOXYLIC ACID

Suppliers and Price of 4-(Ethoxycarbonyl)isothiazole-5-carboxylic 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
Packaging
price

Total 6 raw suppliers

Chemical Property of 4-(Ethoxycarbonyl)isothiazole-5-carboxylic acid

Chemical Property:

PSA：104.73000
LogP:1.01800
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:201.00957888
Heavy Atom Count:13
Complexity:221

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1=C(SN=C1)C(=O)O

Technology Process of 4-(Ethoxycarbonyl)isothiazole-5-carboxylic acid

There total 3 articles about 4-(Ethoxycarbonyl)isothiazole-5-carboxylic 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:

: 98589-62-9
isothiazole-4,5-dicarboxylic acid diethyl ester

: 98279-60-8
isothiazole-4,5-dicarboxylic acid-4-ethyl ester

Guidance literature:: With potassium hydroxide; at -10 - -5 ℃;
DOI:10.1039/jr9590003061

Reference yield:

: 66882-70-0
isothiazole-4,5-dicarboxylic acid

: 98279-60-8
isothiazole-4,5-dicarboxylic acid-4-ethyl ester

Guidance literature:: With ammonium hydroxide; silver nitrate; anschliessend Umsetzung mit Aethyljodid in CHCl₃;
DOI:10.1039/jr9590003061

Reference yield:

: isothiazole-4,5-dicarbonyl chloride

: 98279-60-8
isothiazole-4,5-dicarboxylic acid-4-ethyl ester

Guidance literature:: Multi-step reaction with 2 steps

2: ethanolic KOH / -10 - -5 °C

With potassium hydroxide;
DOI:10.1039/jr9590003061