2-Fluoro-4-[2-(trifluoromethoxy)phenyl]benzoic acid

Base Information

• Chemical Name: 2-Fluoro-4-[2-(trifluoromethoxy)phenyl]benzoic acid
• CAS No.: 926234-72-2
• Molecular Formula: C14H8F4O3
• Molecular Weight: 300.2051328
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID50588060
• Wikidata: Q82480548
• Mol file: 926234-72-2.mol

Synonyms:2-Fluoro-4-[2-(trifluoromethoxy)phenyl]benzoic acid;926234-72-2;C14H8F4O3;3-fluoro-2'-(trifluoromethoxy)-1,1'-biphenyl-4-carboxylic acid;DTXSID50588060;BMB23472;MFCD09042219;AKOS000124611;MCULE-2804486770;BS-33196;EN300-40762;2-Fluoro-4-[2-(trifluoromethoxy)phenyl]benzoicacid;Z363993478;3-fluoro-2'-(trifluoromethoxy)-[1,1'-biphenyl]-4-carboxylic acid;3-Fluoro-2'-(trifluoromethoxy)[1,1'-biphenyl]-4-carboxylic acid

Chemical Property of 2-Fluoro-4-[2-(trifluoromethoxy)phenyl]benzoic acid

Chemical Property:

• Boiling Point: 329.6±42.0 °C(Predicted)
• PKA: 3.18±0.10(Predicted)
• PSA: 46.53000
• Density: 1.417±0.06 g/cm3(Predicted)
• LogP: 4.08950
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 300.04095676
• Heavy Atom Count: 21
• Complexity: 372

Purity/Quality:

2-Fluoro-4-[2-(trifluoromethoxy)phenyl]benzoicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C2=CC(=C(C=C2)C(=O)O)F)OC(F)(F)F