2-fluoro-5-(tributylstannyl)pyridine

• ChemBase ID: 64186
• Molecular Formular: C17H30FNSn
• Molecular Mass: 386.1262032
• Monoisotopic Mass: 387.13842219
• SMILES: n1c(ccc([Sn](CCCC)(CCCC)CCCC)c1)F
• Canonical SMILES: CCCC[Sn](c1ccc(nc1)F)(CCCC)CCCC
• InChI: InChI=1S/C5H3FN.3C4H9.Sn/c6-5-3-1-2-4-7-5;3*1-3-4-2;/h1,3-4H;3*1,3-4H2,2H3
• InChIKey: VLMHLVKGRNNZQF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-fluoro-5-(tributylstannyl)pyridine
• IUPAC Traditional name: 2-fluoro-5-(tributylstannyl)pyridine
• Synonyms: 2-Fluoro-5-(tributylstannyl)pyridine

Database IDs

• CAS Number: 1025687-41-5
• MDL Number: MFCD07787406
• PubChem SID: 162029925
• PubChem CID: 16427100

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 4.4156995
• LogD (pH = 7.4): 4.4157
• Log P: 4.4157
• Molar Refractivity: 82.9642 cm^3
• Polarizability: 36.568832 Å^3
• Polar Surface Area: 12.89 Å^2
• Rotatable Bonds: 10
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT; Toxic
• TSCA Listed: false

Product Information

• Purity: 96%