trifluoro(trimethylsilylsulfonyloxy)methane

C4H9F3O3SSi — CID 15145415

IUPACtrifluoro(trimethylsilylsulfonyloxy)methane
SMILESC[Si](C)(C)S(=O)(=O)OC(F)(F)F
InChIInChI=1S/C4H9F3O3SSi/c1-12(2,3)11(8,9)10-4(5,6)7/h1-3H3
InChIKeyPAGFHWOAZNYBLV-UHFFFAOYSA-N
MW222.26 g/mol
LogP1.69
Rot. Bonds2

About trifluoro(trimethylsilylsulfonyloxy)methane

trifluoro(trimethylsilylsulfonyloxy)methane (PubChem CID 15145415) has the molecular formula C4H9F3O3SSi and a molecular weight of 222.26 g/mol. Its IUPAC name is trifluoro(trimethylsilylsulfonyloxy)methane.

Molecular Properties

Compound Nametrifluoro(trimethylsilylsulfonyloxy)methane
PubChem CID15145415
Molecular FormulaC4H9F3O3SSi
Molecular Weight222.26 g/mol
Exact Mass222.00
IUPAC Nametrifluoro(trimethylsilylsulfonyloxy)methane
SMILESC[Si](C)(C)S(=O)(=O)OC(F)(F)F
InChIInChI=1S/C4H9F3O3SSi/c1-12(2,3)11(8,9)10-4(5,6)7/h1-3H3
InChIKeyPAGFHWOAZNYBLV-UHFFFAOYSA-N
XLogP1.69
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.26
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 trifluoro(trimethylsilylsulfonyloxy)methane?
The IUPAC name of trifluoro(trimethylsilylsulfonyloxy)methane (CID 15145415) is trifluoro(trimethylsilylsulfonyloxy)methane.
What is the SMILES notation for trifluoro(trimethylsilylsulfonyloxy)methane?
The canonical SMILES for trifluoro(trimethylsilylsulfonyloxy)methane is C[Si](C)(C)S(=O)(=O)OC(F)(F)F.
What is the InChIKey of trifluoro(trimethylsilylsulfonyloxy)methane?
The InChIKey is PAGFHWOAZNYBLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9F3O3SSi/c1-12(2,3)11(8,9)10-4(5,6)7/h1-3H3.
What are the key properties of trifluoro(trimethylsilylsulfonyloxy)methane?
trifluoro(trimethylsilylsulfonyloxy)methane has a molecular weight of 222.26 g/mol, XLogP of 1.69, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trifluoro(trimethylsilylsulfonyloxy)methane is sourced from PubChem (CID 15145415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).