4-Thiazolidinecarboxylic acid, 3-(3-mercapto-2-methyl-1-oxopropyl)-

Base Information

• Chemical Name: 4-Thiazolidinecarboxylic acid, 3-(3-mercapto-2-methyl-1-oxopropyl)-
• CAS No.: 67362-29-2
• Molecular Formula: C8H13NO3S2
• Molecular Weight: 235.328
• DSSTox Substance ID: DTXSID90431960
• Nikkaji Number: J291.101I

Synonyms:67362-29-2;4-Thiazolidinecarboxylic acid, 3-(3-mercapto-2-methyl-1-oxopropyl)-;SCHEMBL10681922;DTXSID90431960;3-(3-Mercapto-2-methyl-1-oxopropyl)-4-thiazolidinecarboxylic acid

Chemical Property of 4-Thiazolidinecarboxylic acid, 3-(3-mercapto-2-methyl-1-oxopropyl)-

Chemical Property:

• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 235.03368562
• Heavy Atom Count: 14
• Complexity: 247

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CS)C(=O)N1CSCC1C(=O)O

Technology Process of 4-Thiazolidinecarboxylic acid, 3-(3-mercapto-2-methyl-1-oxopropyl)-

There total 2 articles about 4-Thiazolidinecarboxylic acid, 3-(3-mercapto-2-methyl-1-oxopropyl)- 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: 92.0%

N-<3-(acetylthio)-2-methylpropanoyl>thiazolidine-4-(R)-carboxylic acid (67362-27-0,73642-35-0,100486-63-3) → N-(3-mercapto-2-methylpropanoyl)thiazolidine-4(R)-carboxylic acid (67362-29-2,67714-45-8,67714-46-9,71772-05-9,71772-07-1,98460-88-9)

Guidance literature:

With ammonia; In methanol; for 1.5h; Ambient temperature;

DOI:10.1021/jm00155a032

Reference yield:

→ hexane (110-54-3) + 3-(3-mercapto-2-methylpropanoyl)-L-4-thiazolidinecarboxylic acid (67362-29-2)

Guidance literature:

Reference yield: 50.0%

4-(3-Oxo-3H-benzo[d)-isothiazol-2-yl)benzenesulfonamide (4369-80-6) + 3-(3-mercapto-2-methylpropanoyl)-L-4-thiazolidinecarboxylic acid (67362-29-2) → 3-{2-Methyl-3-[2-(4-sulfamoyl-phenylcarbamoyl)-phenyldisulfanyl]-propionyl}-thiazolidine-4-carboxylic acid

Guidance literature:

In tetrahydrofuran; methanol; at 60 ℃; for 0.5h;

DOI:10.1002/jhet.5570340515

upstream raw materials:

N-<3-(acetylthio)-2-methylpropanoyl>thiazolidine-4-(R)-carboxylic acid

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