2,3-dibromo-5-fluoropyridine

• ChemBase ID: 19172
• Molecular Formular: C5H2Br2FN
• Molecular Mass: 254.8824832
• Monoisotopic Mass: 252.85380129
• SMILES: c1(c(cc(cn1)F)Br)Br
• Canonical SMILES: Fc1cnc(c(c1)Br)Br
• InChI: InChI=1S/C5H2Br2FN/c6-4-1-3(8)2-9-5(4)7/h1-2H
• InChIKey: ASHZMYYXNMJUDZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,3-dibromo-5-fluoropyridine
• IUPAC Traditional name: 2,3-dibromo-5-fluoropyridine
• Synonyms: 2,3-Dibromo-5-fluoropyridine

Database IDs

• CAS Number: 878207-82-0
• MDL Number: MFCD08532501
• PubChem SID: 160982479
• PubChem CID: 22832093

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 2.6413026
• LogD (pH = 7.4): 2.6413026
• Log P: 2.6413026
• Molar Refractivity: 40.2053 cm^3
• Polarizability: 15.452498 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/Light Sensitive/Store under Argon/Keep Cold; IRRITANT
• TSCA Listed: false

Product Information

• Purity: 98%