3-Fluoro-4-(trifluoromethoxy)aniline

Base Information

• Chemical Name: 3-Fluoro-4-(trifluoromethoxy)aniline
• CAS No.: 1017779-69-9
• Molecular Formula: C7H5F4NO
• Molecular Weight: 195.116
• Hs Code.: 2922299090
• European Community (EC) Number: 802-116-4
• DSSTox Substance ID: DTXSID00598816
• Wikidata: Q82494619
• Mol file: 1017779-69-9.mol

Synonyms:3-Fluoro-4-(trifluoromethoxy)aniline;1017779-69-9;Benzenamine, 3-fluoro-4-(trifluoromethoxy)-;MFCD09832383;SCHEMBL7779423;DTXSID00598816;3-fluoro-4-trifluoromethoxy-aniline;BBL102917;STL556726;AKOS006281839;CS-W021916;DS-13267;SY106975;DB-348185;EN300-794514;A897074

Chemical Property of 3-Fluoro-4-(trifluoromethoxy)aniline

Chemical Property:

• Refractive Index: 1.4505
• Boiling Point: 195.7±35.0 °C(Predicted)
• PKA: 2.73±0.10(Predicted)
• PSA: 35.25000
• Density: 1.431±0.06 g/cm3(Predicted)
• LogP: 2.88770
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 195.03072643
• Heavy Atom Count: 13
• Complexity: 172

Purity/Quality:

99% ^*data from raw suppliers

3-Fluoro-4-(trifluoromethoxy)aniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1N)F)OC(F)(F)F