tritert-butyl(trifluoromethyl)silane

C13H27F3Si — CID 134893163

IUPACtritert-butyl(trifluoromethyl)silane
SMILESCC(C)(C)[Si](C(C)(C)C)(C(C)(C)C)C(F)(F)F
InChIInChI=1S/C13H27F3Si/c1-10(2,3)17(11(4,5)6,12(7,8)9)13(14,15)16/h1-9H3
InChIKeyOFAXTHRJIDRJKU-UHFFFAOYSA-N
MW268.44 g/mol
LogP5.94
Rot. Bonds

About tritert-butyl(trifluoromethyl)silane

tritert-butyl(trifluoromethyl)silane (PubChem CID 134893163) has the molecular formula C13H27F3Si and a molecular weight of 268.44 g/mol. Its IUPAC name is tritert-butyl(trifluoromethyl)silane.

Molecular Properties

Compound Nametritert-butyl(trifluoromethyl)silane
PubChem CID134893163
Molecular FormulaC13H27F3Si
Molecular Weight268.44 g/mol
Exact Mass268.18
IUPAC Nametritert-butyl(trifluoromethyl)silane
SMILESCC(C)(C)[Si](C(C)(C)C)(C(C)(C)C)C(F)(F)F
InChIInChI=1S/C13H27F3Si/c1-10(2,3)17(11(4,5)6,12(7,8)9)13(14,15)16/h1-9H3
InChIKeyOFAXTHRJIDRJKU-UHFFFAOYSA-N
XLogP5.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
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 tritert-butyl(trifluoromethyl)silane?
The IUPAC name of tritert-butyl(trifluoromethyl)silane (CID 134893163) is tritert-butyl(trifluoromethyl)silane.
What is the SMILES notation for tritert-butyl(trifluoromethyl)silane?
The canonical SMILES for tritert-butyl(trifluoromethyl)silane is CC(C)(C)[Si](C(C)(C)C)(C(C)(C)C)C(F)(F)F.
What is the InChIKey of tritert-butyl(trifluoromethyl)silane?
The InChIKey is OFAXTHRJIDRJKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27F3Si/c1-10(2,3)17(11(4,5)6,12(7,8)9)13(14,15)16/h1-9H3.
What are the key properties of tritert-butyl(trifluoromethyl)silane?
tritert-butyl(trifluoromethyl)silane has a molecular weight of 268.44 g/mol, XLogP of 5.94, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tritert-butyl(trifluoromethyl)silane is sourced from PubChem (CID 134893163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).