4-Chloro-2-(trifluoromethyl)quinoline

• Catalog: OFC1701242
• CAS: 1701-24-2
• Category: Fluorinated Quinolines
• Synonyms: Quinoline, 4-chloro-2-(trifluoromethyl)-
• Purity: >97.0%(GC)
• MDL Number: MFCD00153105

• IUPAC Name: 4-chloro-2-(trifluoromethyl)quinoline
• InChI: InChI=1S/C10H5ClF3N/c11-7-5-9(10(12,13)14)15-8-4-2-1-3-6(7)8/h1-5H
• InChI Key: ONNDFDQMHCNEGF-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC=C2C(=C1)C(=CC(=N2)C(F)(F)F)Cl
• EC Number: 625-773-7
• Reaxys Registry Number: 1246240

• Molecular Formula: C10H5ClF3N
• Molecular Weight: 231.60
• Melting Point: 34.0-38.0 °C
• Appearance: White or colorless to almost white or almost colorless powder to lump to clear liquid
• Storage: 0-10 °C

• 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