tributyl(4-methylphenyl)stannane

• ChemBase ID: 89612
• Molecular Formular: C19H34Sn
• Molecular Mass: 381.17426
• Monoisotopic Mass: 382.16824509
• SMILES: [Sn](c1ccc(cc1)C)(CCCC)(CCCC)CCCC
• Canonical SMILES: CCCC[Sn](c1ccc(cc1)C)(CCCC)CCCC
• InChI: InChI=1S/C7H7.3C4H9.Sn/c1-7-5-3-2-4-6-7;3*1-3-4-2;/h3-6H,1H3;3*1,3-4H2,2H3
• InChIKey: GKXMWFAVHWCSJP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tributyl(4-methylphenyl)stannane
• IUPAC Traditional name: tributyl(4-methylphenyl)stannane
• Synonyms: (4-Methylphenyl)tributylstannane; (p-Tolyl)tributylstannane; 4-(Tributylstannyl)toluene

Database IDs

• PubChem SID: 162104721
• PubChem CID: 11783849

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 5.5981
• LogD (pH = 7.4): 5.5981
• Log P: 5.5981
• Molar Refractivity: 88.9312 cm^3
• Polarizability: 39.473988 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 10
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Warning: Toxic