4-Methyl-3-sulfanylpentan-2-one

Base Information

• Chemical Name: 4-Methyl-3-sulfanylpentan-2-one
• CAS No.: 75832-79-0
• Molecular Formula: C6H12 O S
• Molecular Weight: 132.22388
• Hs Code.: 2930909090
• DSSTox Substance ID: DTXSID70600091
• Mol file: 75832-79-0.mol

Synonyms:4-methyl-3-sulfanylpentan-2-one;75832-79-0;2-Pentanone,3-mercapto-4-methyl-;3-Mercapto-2-methylpentanone;SCHEMBL4733221;DTXSID70600091;3-MERCAPTO-4-METHYL-2-PENTANONE;2-PENTANONE, 3-MERCAPTO-4-METHYL-;DB-270659;EN300-7591590

Chemical Property of 4-Methyl-3-sulfanylpentan-2-one

Chemical Property:

• PSA: 55.87000
• LogP: 1.52980
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 132.06088618
• Heavy Atom Count: 8
• Complexity: 88.5

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(C(=O)C)S

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