3-Oxo-2-(thiophene-2-carbonyl)butyric acid methyl ester

Base Information

• Chemical Name: 3-Oxo-2-(thiophene-2-carbonyl)butyric acid methyl ester
• CAS No.: 676348-57-5
• Molecular Formula: C10H10O4S
• Molecular Weight: 226.25
• European Community (EC) Number: 673-453-0
• DSSTox Substance ID: DTXSID00375088
• Mol file: 676348-57-5.mol

Synonyms:3-Oxo-2-(thiophene-2-carbonyl)butyric acid methyl ester;676348-57-5;Methyl 3-oxo-2-(thiophene-2-carbonyl)butanoate;3-OXO-2-(THIOPHENE-2-CARBONYL)-BUTYRIC ACID METHYL ESTER;DTXSID00375088;A835836

Chemical Property of 3-Oxo-2-(thiophene-2-carbonyl)butyric acid methyl ester

Chemical Property:

• PSA: 88.68000
• LogP: 1.30900
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 226.02997997
• Heavy Atom Count: 15
• Complexity: 287

Purity/Quality:

98%min ^*data from raw suppliers

3-OXO-2-(THIOPHENE-2-CARBONYL)BUTYRIC ACID METHYL ESTER 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C(C(=O)C1=CC=CS1)C(=O)OC