4-methyl-6-(tributylstannyl)pyrimidine

• ChemBase ID: 801448
• Molecular Formular: C17H32N2Sn
• Molecular Mass: 383.15038
• Monoisotopic Mass: 384.15874303
• SMILES: c1c(ncnc1C)[Sn](CCCC)(CCCC)CCCC
• Canonical SMILES: CCCC[Sn](c1ncnc(c1)C)(CCCC)CCCC
• InChI: InChI=1S/C5H5N2.3C4H9.Sn/c1-5-2-3-6-4-7-5;3*1-3-4-2;/h2,4H,1H3;3*1,3-4H2,2H3
• InChIKey: VXQBBXFCLNWSDS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-methyl-6-(tributylstannyl)pyrimidine
• IUPAC Traditional name: 4-methyl-6-(tributylstannyl)pyrimidine
• Synonyms: 6-METHYL-4-(TRIBUTYLSTANNYL)PYRIMIDINE

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 3.863201
• LogD (pH = 7.4): 3.8668532
• Log P: 3.8669
• Molar Refractivity: 85.4593 cm^3
• Polarizability: 37.734055 Å^3
• Polar Surface Area: 25.78 Å^2
• Rotatable Bonds: 10
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%