[ethenyl(dimethyl)silyl] trifluoromethanesulfonate

C5H9F3O3SSi — CID 53466158

IUPAC[ethenyl(dimethyl)silyl] trifluoromethanesulfonate
SMILESC=C[Si](C)(C)OS(=O)(=O)C(F)(F)F
InChIInChI=1S/C5H9F3O3SSi/c1-4-13(2,3)11-12(9,10)5(6,7)8/h4H,1H2,2-3H3
InChIKeyRCIVUDHZRWJIFK-UHFFFAOYSA-N
MW234.27 g/mol
LogP1.78
Rot. Bonds3

About [ethenyl(dimethyl)silyl] trifluoromethanesulfonate

[ethenyl(dimethyl)silyl] trifluoromethanesulfonate (PubChem CID 53466158) has the molecular formula C5H9F3O3SSi and a molecular weight of 234.27 g/mol. Its IUPAC name is [ethenyl(dimethyl)silyl] trifluoromethanesulfonate.

Molecular Properties

Compound Name[ethenyl(dimethyl)silyl] trifluoromethanesulfonate
PubChem CID53466158
Molecular FormulaC5H9F3O3SSi
Molecular Weight234.27 g/mol
Exact Mass234.00
IUPAC Name[ethenyl(dimethyl)silyl] trifluoromethanesulfonate
SMILESC=C[Si](C)(C)OS(=O)(=O)C(F)(F)F
InChIInChI=1S/C5H9F3O3SSi/c1-4-13(2,3)11-12(9,10)5(6,7)8/h4H,1H2,2-3H3
InChIKeyRCIVUDHZRWJIFK-UHFFFAOYSA-N
XLogP1.78
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.27
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[dimethyl(3-methylbut-1-en-2-yloxy)silyl] trifluoromethanesulfonate
CID 10266340
[methyl(diphenyl)silyl] trifluoromethanesulfonate
CID 15734356
[dimethyl(phenyl)silyl] trifluoromethanesulfonate
CID 13495210
prop-2-enyl trifluoromethanesulfonate;silane
CID 174615184
bis(trimethylsilyl)methyl trifluoromethanesulfonate
CID 87370249
(methyldisulfanyl)methane;trifluoromethylsulfonyl trifluoromethanesulfonate
CID 23649989
copper;methyl trifluoromethanesulfonate
CID 174775711
methyl trifluoromethanesulfonate;silver
CID 174859792
1-iodopyrrolidine-2,5-dione;trimethylsilyl trifluoromethanesulfonate
CID 87435306
CID 101386423
CID 101386423
[ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate
CID 15864568
but-2-en-2-yl trifluoromethanesulfonate
CID 58952347

Frequently Asked Questions

What is the IUPAC name of [ethenyl(dimethyl)silyl] trifluoromethanesulfonate?
The IUPAC name of [ethenyl(dimethyl)silyl] trifluoromethanesulfonate (CID 53466158) is [ethenyl(dimethyl)silyl] trifluoromethanesulfonate.
What is the SMILES notation for [ethenyl(dimethyl)silyl] trifluoromethanesulfonate?
The canonical SMILES for [ethenyl(dimethyl)silyl] trifluoromethanesulfonate is C=C[Si](C)(C)OS(=O)(=O)C(F)(F)F.
What is the InChIKey of [ethenyl(dimethyl)silyl] trifluoromethanesulfonate?
The InChIKey is RCIVUDHZRWJIFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F3O3SSi/c1-4-13(2,3)11-12(9,10)5(6,7)8/h4H,1H2,2-3H3.
What are the key properties of [ethenyl(dimethyl)silyl] trifluoromethanesulfonate?
[ethenyl(dimethyl)silyl] trifluoromethanesulfonate has a molecular weight of 234.27 g/mol, XLogP of 1.78, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [ethenyl(dimethyl)silyl] trifluoromethanesulfonate is sourced from PubChem (CID 53466158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).