4-[[(Dichlorofluoromethyl)thio](trifluoromethyl)amino]benzoic acid

Base Information

• Chemical Name: 4-[[(Dichlorofluoromethyl)thio](trifluoromethyl)amino]benzoic acid
• CAS No.: 29363-53-9
• Molecular Formula: C9H5 Cl2 F4 N O2 S
• Molecular Weight: 338.1061
• European Community (EC) Number: 249-586-1
• DSSTox Substance ID: DTXSID80951905
• Nikkaji Number: J250.825G
• Wikidata: Q82930366
• Mol file: 29363-53-9.mol

Synonyms:29363-53-9;4-[[(DICHLOROFLUOROMETHYL)THIO](TRIFLUOROMETHYL)AMINO]BENZOIC ACID;EINECS 249-586-1;4-(((Dichlorofluoromethyl)thio)(trifluoromethyl)amino)benzoic acid;C9H5Cl2F4NO2S;SCHEMBL10815555;DTXSID80951905;C9-H5-Cl2-F4-N-O2-S;4-[{[Dichloro(fluoro)methyl]sulfanyl}(trifluoromethyl)amino]benzoic acid

Chemical Property of 4-[[(Dichlorofluoromethyl)thio](trifluoromethyl)amino]benzoic acid

Chemical Property:

• Vapor Pressure: 0.000576mmHg at 25°C
• Boiling Point: 298.2°Cat760mmHg
• Flash Point: 134.2°C
• PSA: 65.84000
• Density: 1.702g/cm³
• LogP: 4.41760
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 336.9354176
• Heavy Atom Count: 19
• Complexity: 335

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1C(=O)O)N(C(F)(F)F)SC(F)(Cl)Cl