2-{Phenyl[3-(trifluoromethyl)phenyl]amino}benzoic acid

Base Information

• Chemical Name: 2-{Phenyl[3-(trifluoromethyl)phenyl]amino}benzoic acid
• CAS No.: 85010-08-8
• Molecular Formula: C20H14 F3 N O2
• Molecular Weight: 357.33
• DSSTox Substance ID: DTXSID101198326
• Mol file: 85010-08-8.mol

Synonyms:85010-08-8;Benzoic acid, 2-[phenyl[3-(trifluoromethyl)phenyl]amino]-;2-{Phenyl[3-(trifluoromethyl)phenyl]amino}benzoic acid;SCHEMBL10946240;Benzoic acid, 2-[phenyl[3-(trifluoromethyl)phenyl]amino]-;IEPOWEALVQJTFU-UHFFFAOYSA-N;DTXSID101198326;AKOS002662892

Chemical Property of 2-{Phenyl[3-(trifluoromethyl)phenyl]amino}benzoic acid

Chemical Property:

• PSA: 40.54000
• LogP: 5.87340
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 357.09766318
• Heavy Atom Count: 26
• Complexity: 476

Purity/Quality:

2-[PHENYL[3-(TRIFLUOROMETHYL)PHENYL]AMINO]-BENZOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)N(C2=CC=CC(=C2)C(F)(F)F)C3=CC=CC=C3C(=O)O