1,1,1-Trifluoro-4-phenyl-4-sulfanylidenebutan-2-one

Base Information

• Chemical Name: 1,1,1-Trifluoro-4-phenyl-4-sulfanylidenebutan-2-one
• CAS No.: 53657-07-1
• Molecular Formula: C₁₀H₇F₃OS
• Molecular Weight: 232.226
• DSSTox Substance ID: DTXSID00568216
• Wikidata: Q82454396

Synonyms:1,1,1-Trifluoro-4-phenyl-4-sulfanylidenebutan-2-one;53657-07-1;monothiobenzoyltrifluoroacetone;DTXSID00568216;MDPWQVWAWSXEBQ-UHFFFAOYSA-N

Chemical Property of 1,1,1-Trifluoro-4-phenyl-4-sulfanylidenebutan-2-one

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 232.01697050
• Heavy Atom Count: 15
• Complexity: 254

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=S)CC(=O)C(F)(F)F

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