Methyl [(2-oxobutyl)sulfanyl]acetate

Base Information

• Chemical Name: Methyl [(2-oxobutyl)sulfanyl]acetate
• CAS No.: 61363-63-1
• Molecular Formula: C7H12O3S
• DSSTox Substance ID: DTXSID90493528
• Wikidata: Q82340271

Synonyms:61363-63-1;Methyl [(2-oxobutyl)sulfanyl]acetate;SCHEMBL6351080;DTXSID90493528;LSVOGJNOXYTIKJ-UHFFFAOYSA-N;Methyl 2-(2-oxobutylthio)acetate;AKOS011317876;methyl 2-(3-methylacetonylmercapto)acetate

Chemical Property of Methyl [(2-oxobutyl)sulfanyl]acetate

Chemical Property:

• XLogP3: 1
• 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: CCC(=O)CSCC(=O)OC

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