5-(tributylstannyl)-2-[tris(propan-2-yl)silyl]-1,3-oxazole

• ChemBase ID: 65200
• Molecular Formular: C24H49NOSiSn
• Molecular Mass: 514.43846
• Monoisotopic Mass: 515.26053573
• SMILES: o1c(cnc1[Si](C(C)C)(C(C)C)C(C)C)[Sn](CCCC)(CCCC)CCCC
• Canonical SMILES: CCCC[Sn](c1cnc(o1)[Si](C(C)C)(C(C)C)C(C)C)(CCCC)CCCC
• InChI: InChI=1S/C12H22NOSi.3C4H9.Sn/c1-9(2)15(10(3)4,11(5)6)12-13-7-8-14-12;3*1-3-4-2;/h7,9-11H,1-6H3;3*1,3-4H2,2H3
• InChIKey: TWSMTGCRUGWDPG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5-(tributylstannyl)-2-[tris(propan-2-yl)silyl]-1,3-oxazole
• IUPAC Traditional name: 5-(tributylstannyl)-2-(triisopropylsilyl)-1,3-oxazole
• Synonyms: 5-(Tributylstannyl)-2-triisopropylsilyloxazole

Database IDs

• CAS Number: 869542-43-8
• MDL Number: MFCD18325157
• PubChem SID: 162030939
• PubChem CID: 11497195

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 7.0727754
• LogD (pH = 7.4): 7.0727997
• Log P: 7.0728
• Molar Refractivity: 117.187 cm^3
• Polarizability: 53.22163 Å^3
• Polar Surface Area: 26.03 Å^2
• Rotatable Bonds: 14
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95%