4-Chloro-8-(trifluoromethyl)quinoline

• Catalog: OFC23779977
• CAS: 23779-97-7
• Category: Fluorinated Quinolines
• Synonyms: Quinoline, 4-chloro-8-(trifluoromethyl)-
• Purity: >98.0%(GC)
• MDL Number: MFCD00134578

• IUPAC Name: 4-chloro-8-(trifluoromethyl)quinoline
• InChI: InChI=1S/C10H5ClF3N/c11-8-4-5-15-9-6(8)2-1-3-7(9)10(12,13)14/h1-5H
• InChI Key: LINGICLAECZKAW-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC2=C(C=CN=C2C(=C1)C(F)(F)F)Cl
• EC Number: 245-880-9
• Reaxys Registry Number: 1285950

• Molecular Formula: C10H5ClF3N
• Molecular Weight: 231.60
• Melting Point: 78.0-82.0 °C
• Appearance: White to orange to green powder to crystal

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 231.0062613 g/mol
• Monoisotopic Mass: 231.0062613 g/mol
• Topological Polar Surface Area: 12.9Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 231

• HS Number: 2933.49.7000