tributyl(trifluoromethyl)silane

C13H27F3Si — CID 14343495

IUPACtributyl(trifluoromethyl)silane
SMILESCCCC[Si](CCCC)(CCCC)C(F)(F)F
InChIInChI=1S/C13H27F3Si/c1-4-7-10-17(11-8-5-2,12-9-6-3)13(14,15)16/h4-12H2,1-3H3
InChIKeyOFHCMIAMEFGCTH-UHFFFAOYSA-N
MW268.44 g/mol
LogP5.94
Rot. Bonds9

About tributyl(trifluoromethyl)silane

tributyl(trifluoromethyl)silane (PubChem CID 14343495) has the molecular formula C13H27F3Si and a molecular weight of 268.44 g/mol. Its IUPAC name is tributyl(trifluoromethyl)silane.

Molecular Properties

Compound Nametributyl(trifluoromethyl)silane
PubChem CID14343495
Molecular FormulaC13H27F3Si
Molecular Weight268.44 g/mol
Exact Mass268.18
IUPAC Nametributyl(trifluoromethyl)silane
SMILESCCCC[Si](CCCC)(CCCC)C(F)(F)F
InChIInChI=1S/C13H27F3Si/c1-4-7-10-17(11-8-5-2,12-9-6-3)13(14,15)16/h4-12H2,1-3H3
InChIKeyOFHCMIAMEFGCTH-UHFFFAOYSA-N
XLogP5.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.44
LogP ≤ 55.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tributyl(trifluoromethyl)silane?
The IUPAC name of tributyl(trifluoromethyl)silane (CID 14343495) is tributyl(trifluoromethyl)silane.
What is the SMILES notation for tributyl(trifluoromethyl)silane?
The canonical SMILES for tributyl(trifluoromethyl)silane is CCCC[Si](CCCC)(CCCC)C(F)(F)F.
What is the InChIKey of tributyl(trifluoromethyl)silane?
The InChIKey is OFHCMIAMEFGCTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27F3Si/c1-4-7-10-17(11-8-5-2,12-9-6-3)13(14,15)16/h4-12H2,1-3H3.
What are the key properties of tributyl(trifluoromethyl)silane?
tributyl(trifluoromethyl)silane has a molecular weight of 268.44 g/mol, XLogP of 5.94, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(trifluoromethyl)silane is sourced from PubChem (CID 14343495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).