{2-[(6-methoxypyridin-3-yl)dimethylsilyl]phenyl}methanol

• ChemBase ID: 297821
• Molecular Formular: C15H19NO2Si
• Molecular Mass: 273.40236
• Monoisotopic Mass: 273.11850539
• SMILES: COc1ccc(cn1)[Si](C)(C)c1ccccc1CO
• Canonical SMILES: COc1ccc(cn1)[Si](c1ccccc1CO)(C)C
• InChI: InChI=1S/C15H19NO2Si/c1-18-15-9-8-13(10-16-15)19(2,3)14-7-5-4-6-12(14)11-17/h4-10,17H,11H2,1-3H3
• InChIKey: GVPVJLHNKPZVIV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: {2-[(6-methoxypyridin-3-yl)dimethylsilyl]phenyl}methanol
• IUPAC Traditional name: {2-[(6-methoxypyridin-3-yl)dimethylsilyl]phenyl}methanol
• Synonyms: 2-[(6-Methoxy-3-pyridyl)dimethylsilyl]benzyl alcohol; 2-[(6-甲氧基-3-吡啶基)二甲基硅烷]苄醇

Database IDs

• MDL Number: MFCD16251554
• PubChem SID: 180683352
• PubChem CID: 71306637

CALCULATED PROPERTIES

• Acid pKa: 15.013046
• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): 3.2879152
• LogD (pH = 7.4): 3.2890851
• Log P: 3.2891
• Molar Refractivity: 73.4825 cm^3
• Polarizability: 30.617065 Å^3
• Polar Surface Area: 42.35 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 26-37
• TSCA Listed: 否
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305+P351+P338-P302+P352-P321-P405-P501A

Product Information

• Purity: 95%