2-[(2,2,2-Trifluoroethyl)sulfanyl]benzoic acid

Base Information

• Chemical Name: 2-[(2,2,2-Trifluoroethyl)sulfanyl]benzoic acid
• CAS No.: 162965-55-1
• Molecular Formula: C9H7F3O2S
• European Community (EC) Number: 832-915-3
• DSSTox Substance ID: DTXSID401265134
• Mol file: 162965-55-1.mol

Synonyms:2-[(2,2,2-trifluoroethyl)sulfanyl]benzoic acid;162965-55-1;2-((2,2,2-Trifluoroethyl)thio)benzoic acid;2-(2,2,2-trifluoroethylsulfanyl)benzoic acid;2-[(2,2,2-Trifluoroethyl)thio]benzoic acid;SCHEMBL4597973;DTXSID401265134;MFCD09735608;AKOS000142980;MCULE-5084287389;2-(2,2,2-Trifluoroethylthio)benzoic acid;2-((2,2,2-Trifluoroethyl)thio)benzoicacid;EN300-41897;2-(2',2',2'-trifluoroethylthio)benzoic acid;G54911;2-[(2,2,2-Trifluoroethyl)sulphanyl]benzoic acid;Z239951682

Chemical Property of 2-[(2,2,2-Trifluoroethyl)sulfanyl]benzoic acid

Chemical Property:

• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 236.01188512
• Heavy Atom Count: 15
• Complexity: 230

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

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

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