4-Amino-5,7-bis(trifluoromethyl)quinoline

• Catalog: OFC874880236
• CAS: 874880-23-6
• Category: Fluorinated Quinolines
• Synonyms: 5,7-Bis(trifluoromethyl)quinolin-4-amine
• MDL Number: MFCD08059367

• IUPAC Name: 5,7-bis(trifluoromethyl)quinolin-4-amine
• InChI: InChI=1S/C11H6F6N2/c12-10(13,14)5-3-6(11(15,16)17)9-7(18)1-2-19-8(9)4-5/h1-4H,(H2,18,19)
• InChI Key: HYBGMYPZHMAZOG-UHFFFAOYSA-N
• Isomeric SMILES: C1=CN=C2C=C(C=C(C2=C1N)C(F)(F)F)C(F)(F)F

• Molecular Formula: C11H6F6N2
• Molecular Weight: 280.17

• XLogP3-AA: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 0
• Exact Mass: 280.04351717 g/mol
• Monoisotopic Mass: 280.04351717 g/mol
• Topological Polar Surface Area: 38.9Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 326