2,3-dichloro-5-fluoropyridine

• ChemBase ID: 97838
• Molecular Formular: C5H2Cl2FN
• Molecular Mass: 165.9804832
• Monoisotopic Mass: 164.95483265
• SMILES: n1c(c(cc(c1)F)Cl)Cl
• Canonical SMILES: Fc1cnc(c(c1)Cl)Cl
• InChI: InChI=1S/C5H2Cl2FN/c6-4-1-3(8)2-9-5(4)7/h1-2H
• InChIKey: YIYIQENCPIISLL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,3-dichloro-5-fluoropyridine
• IUPAC Traditional name: 2,3-dichloro-5-fluoropyridine
• Synonyms: 2,3-Dichloro-5-fluoropyridine

Database IDs

• CAS Number: 185985-40-4
• PubChem SID: 162084376
• PubChem CID: 18520008

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 2.326542
• LogD (pH = 7.4): 2.326542
• Log P: 2.326542
• Molar Refractivity: 34.7884 cm^3
• Polarizability: 13.156068 Å^3
• Polar Surface Area: 12.89 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Harmful/Irritant

Product Information

• Purity: 95+%