3-Pentanone, 1,1,2-trifluoro-1-(phenylthio)-

Base Information

• Chemical Name: 3-Pentanone, 1,1,2-trifluoro-1-(phenylthio)-
• CAS No.: 101361-07-3
• Molecular Formula: C11H11F3OS
• DSSTox Substance ID: DTXSID60542118
• Mol file: 101361-07-3.mol

Synonyms:101361-07-3;3-Pentanone, 1,1,2-trifluoro-1-(phenylthio)-;SCHEMBL10706797;DTXSID60542118;BDNAOCUYNSIQFL-UHFFFAOYSA-N;1,1,2-Trifluoro-1-(phenylsulfanyl)pentan-3-one

Chemical Property of 3-Pentanone, 1,1,2-trifluoro-1-(phenylthio)-

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 248.04827063
• Heavy Atom Count: 16
• Complexity: 239

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=O)C(C(F)(F)SC1=CC=CC=C1)F

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