Methyl 4-acetylsulfanyl-2-methyl-3-oxopentanoate

Base Information

• Chemical Name: Methyl 4-acetylsulfanyl-2-methyl-3-oxopentanoate
• CAS No.: 95628-73-2
• Molecular Formula: C₉H₁₄O₄S
• Molecular Weight: 218.274
• DSSTox Substance ID: DTXSID00580519

Synonyms:methyl 4-S-acetyl-2,5-dideoxy-2-methyl-4-thiopent-3-ulosonate;95628-73-2;methyl 4-acetylsulfanyl-2-methyl-3-oxopentanoate;DTXSID00580519

Chemical Property of Methyl 4-acetylsulfanyl-2-methyl-3-oxopentanoate

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 218.06128010
• Heavy Atom Count: 14
• Complexity: 249

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MSDS Files:

Useful:

• Canonical SMILES: CC(C(=O)C(C)SC(=O)C)C(=O)OC

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