2-((8-(Trifluoromethyl)quinolin-4-yl)oxy)acetic acid

• Catalog: OFC845264815
• CAS: 845264-81-5
• Category: Fluorinated Quinolines
• Synonyms: (8-trifluoromethylquinolin-4-yloxy)-acetic acid
• Purity: 97%

• IUPAC Name: 2-[8-(trifluoromethyl)quinolin-4-yl]oxyacetic acid
• InChI: InChI=1S/C12H8F3NO3/c13-12(14,15)8-3-1-2-7-9(19-6-10(17)18)4-5-16-11(7)8/h1-5H,6H2,(H,17,18)
• InChI Key: YFHDVQJQLNVBPG-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC2=C(C=CN=C2C(=C1)C(F)(F)F)OCC(=O)O

• Molecular Formula: C12H8F3NO3
• Molecular Weight: 271.19

• XLogP3-AA: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 271.04562760 g/mol
• Monoisotopic Mass: 271.04562760 g/mol
• Topological Polar Surface Area: 59.4Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 335