tributyl(3-methylthiophen-2-yl)stannane

• ChemBase ID: 64231
• Molecular Formular: C17H32SSn
• Molecular Mass: 387.20198
• Monoisotopic Mass: 388.12466602
• SMILES: c1(c(ccs1)C)[Sn](CCCC)(CCCC)CCCC
• Canonical SMILES: CCCC[Sn](c1sccc1C)(CCCC)CCCC
• InChI: InChI=1S/C5H5S.3C4H9.Sn/c1-5-2-3-6-4-5;3*1-3-4-2;/h2-3H,1H3;3*1,3-4H2,2H3
• InChIKey: MSKNSVGPYFVXHC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tributyl(3-methylthiophen-2-yl)stannane
• IUPAC Traditional name: tributyl(3-methylthiophen-2-yl)stannane
• Synonyms: 3-Methyl-2-(tributylstannyl)thiophene

Database IDs

• CAS Number: 166766-89-8
• MDL Number: MFCD09025807
• PubChem SID: 162029970
• PubChem CID: 15211846

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 5.192
• LogD (pH = 7.4): 5.192
• Log P: 5.192
• Molar Refractivity: 85.1969 cm^3
• Polarizability: 38.161804 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 10
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

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

Product Information

• Purity: 94%