4-Methylsulfanyl-2-oxo-butyric acid ethyl ester

Base Information

• Chemical Name: 4-Methylsulfanyl-2-oxo-butyric acid ethyl ester
• CAS No.: 84688-35-7
• Molecular Formula: C7H12O3S
• Molecular Weight: 176.236
• DSSTox Substance ID: DTXSID80437138
• Wikidata: Q82252519

Synonyms:4-Methylsulfanyl-2-oxo-butyric acid ethyl ester;84688-35-7;SCHEMBL2704237;DTXSID80437138;XAWVVCXKRKVDNN-UHFFFAOYSA-N;FT-0765859

Chemical Property of 4-Methylsulfanyl-2-oxo-butyric acid ethyl ester

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 176.05071541
• Heavy Atom Count: 11
• Complexity: 145

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(=O)CCSC

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