3,5-Difluoro-4-(trifluoromethyl)phenol

Base Information

• Chemical Name: 3,5-Difluoro-4-(trifluoromethyl)phenol
• CAS No.: 116640-11-0
• Molecular Formula: C7H3F5O
• Molecular Weight: 198.092
• Hs Code.: 2908190090
• DSSTox Substance ID: DTXSID80557466
• Wikidata: Q82439386
• Mol file: 116640-11-0.mol

Synonyms:3,5-DIFLUORO-4-(TRIFLUOROMETHYL)PHENOL;116640-11-0;Phenol, 3,5-difluoro-4-(trifluoromethyl)-;SCHEMBL759007;AMY8724;DTXSID80557466;MFCD19441183;3,5-difluoro-4-trifluoromethyl-phenol;AKOS015853181;BS-14497;CS-0157708;3,5-DIFLUORO-4-(TRIFLUOROMETHYL)PHENOL (79% W/W IN DMF)

Chemical Property of 3,5-Difluoro-4-(trifluoromethyl)phenol

Chemical Property:

• Boiling Point: 210.2±35.0 °C(Predicted)
• PKA: 6.59±0.23(Predicted)
• PSA: 20.23000
• Density: 1.526±0.06 g/cm3(Predicted)
• LogP: 2.68920
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 198.01040553
• Heavy Atom Count: 13
• Complexity: 168

Purity/Quality:

98%min ^*data from raw suppliers

3,5-Difluoro-4-(trifluoromethyl)phenol 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1F)C(F)(F)F)F)O