6-[3-(trimethylsilyl)phenyl]pyridine-2-carbaldehyde

• ChemBase ID: 811484
• Molecular Formular: C15H17NOSi
• Molecular Mass: 255.38708
• Monoisotopic Mass: 255.1079407
• SMILES: n1c(cccc1c1cc(ccc1)[Si](C)(C)C)C=O
• Canonical SMILES: O=Cc1cccc(n1)c1cccc(c1)[Si](C)(C)C
• InChI: InChI=1S/C15H17NOSi/c1-18(2,3)14-8-4-6-12(10-14)15-9-5-7-13(11-17)16-15/h4-11H,1-3H3
• InChIKey: XFQZYMASFQXGOO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-[3-(trimethylsilyl)phenyl]pyridine-2-carbaldehyde
• IUPAC Traditional name: 6-[3-(trimethylsilyl)phenyl]pyridine-2-carbaldehyde
• Synonyms: 6-[3-(TRIMETHYLSILYL)PHENYL]PYRIDINE-2-CARBALDEHYDE

CALCULATED PROPERTIES

• Rotatable Bonds: 3
• Lipinski's Rule of Five: true
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 4.835075
• LogD (pH = 7.4): 4.836087
• Log P: 4.8361
• Molar Refractivity: 70.9277 cm^3
• Polarizability: 30.7941 Å^3
• Polar Surface Area: 29.96 Å^2

PROPERTIES

Product Information

• Purity: 98%