2,4-Dichloro-5-fluoropyrimidine

• Catalog: OFC2927711
• CAS: 2927-71-1
• Category: Fluorinated Pyrimidines
• Synonyms: 5-fluoro-2,4-dichloropyrimidine
• Purity: >98.0%(GC)

• IUPAC Name: 2,4-dichloro-5-fluoropyrimidine
• InChI: InChI=1S/C4HCl2FN2/c5-3-2(7)1-8-4(6)9-3/h1H
• InChI Key: WHPFEQUEHBULBW-UHFFFAOYSA-N
• Isomeric SMILES: C1=C(C(=NC(=N1)Cl)Cl)F
• EC Number: 625-810-7
• Reaxys Registry Number: 607964

• Molecular Formula: C4HCl2FN2
• Molecular Weight: 166.96
• Melting Point: 37.0-41.0 °C
• Boiling Point: 80 °C (16 mmHg)
• Appearance: White to almost white powder to lump
• Storage: 0-10°C; Store under inert gas

• XLogP3-AA: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 165.9500816 g/mol
• Monoisotopic Mass: 165.9500816 g/mol
• Topological Polar Surface Area: 25.8Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 103

• HS Number: 2933.59.9500