tributyl(trifluoroprop-1-yn-1-yl)stannane

• ChemBase ID: 64377
• Molecular Formular: C15H27F3Sn
• Molecular Mass: 383.0710896
• Monoisotopic Mass: 384.10867952
• SMILES: C(#CC(F)(F)F)[Sn](CCCC)(CCCC)CCCC
• Canonical SMILES: CCCC[Sn](C#CC(F)(F)F)(CCCC)CCCC
• InChI: InChI=1S/3C4H9.C3F3.Sn/c3*1-3-4-2;1-2-3(4,5)6;/h3*1,3-4H2,2H3
• InChIKey: XDLXCIZDZFHGEZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tributyl(trifluoroprop-1-yn-1-yl)stannane
• IUPAC Traditional name: tributyl(trifluoroprop-1-yn-1-yl)stannane
• Synonyms: 1-Tributylstannyl-3,3,3-trifluoro-1-propyne

Database IDs

• CAS Number: 64185-12-2
• MDL Number: MFCD11109352
• PubChem SID: 162030116
• PubChem CID: 11199932

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 7.7939
• LogD (pH = 7.4): 7.7939
• Log P: 7.7939
• Molar Refractivity: 71.832 cm^3
• Polarizability: 32.035126 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 11
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 90+%