[ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate

C7H6F6O4Si — CID 15864568

IUPAC[ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate
SMILESC=C[Si](C)(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F
InChIInChI=1S/C7H6F6O4Si/c1-3-18(2,16-4(14)6(8,9)10)17-5(15)7(11,12)13/h3H,1H2,2H3
InChIKeyDDCOIPVXVGGRCJ-UHFFFAOYSA-N
MW296.20 g/mol
LogP1.99
Rot. Bonds3

About [ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate

[ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate (PubChem CID 15864568) has the molecular formula C7H6F6O4Si and a molecular weight of 296.20 g/mol. Its IUPAC name is [ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate.

Molecular Properties

Compound Name[ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate
PubChem CID15864568
Molecular FormulaC7H6F6O4Si
Molecular Weight296.20 g/mol
Exact Mass295.99
IUPAC Name[ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate
SMILESC=C[Si](C)(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F
InChIInChI=1S/C7H6F6O4Si/c1-3-18(2,16-4(14)6(8,9)10)17-5(15)7(11,12)13/h3H,1H2,2H3
InChIKeyDDCOIPVXVGGRCJ-UHFFFAOYSA-N
XLogP1.99
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.20
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

triethylsilyl 2,2,2-trifluoroacetate
CID 11831178
nickel;prop-2-enyl 2,2,2-trifluoroacetate
CID 88780784
palladium;prop-2-enyl 2,2,2-trifluoroacetate
CID 175036312
(2,2,2-trifluoroacetyl) prop-2-eneperoxoate
CID 140517984
dimethylphosphoryl 2,2,2-trifluoroacetate
CID 154646257
bis[(2,2,2-trifluoroacetyl)oxy]stibanyl 2,2,2-trifluoroacetate
CID 16685221
CID 18787773
CID 18787773
[ethenyl(dimethyl)silyl] trifluoromethanesulfonate
CID 53466158
copper(1+);ethenyl(trimethyl)silane;(Z)-1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate
CID 165360048
[decyl-bis[(2,2,2-trifluoroacetyl)oxy]silyl] 2,2,2-trifluoroacetate
CID 175690446
[(Z)-5-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)pent-3-enyl] 2,2,2-trifluoroacetate
CID 141051431
3,3-dimethylbut-1-en-2-yl 2,2,2-trifluoroacetate
CID 12871431

Frequently Asked Questions

What is the IUPAC name of [ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate?
The IUPAC name of [ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate (CID 15864568) is [ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate.
What is the SMILES notation for [ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate?
The canonical SMILES for [ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate is C=C[Si](C)(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F.
What is the InChIKey of [ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate?
The InChIKey is DDCOIPVXVGGRCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F6O4Si/c1-3-18(2,16-4(14)6(8,9)10)17-5(15)7(11,12)13/h3H,1H2,2H3.
What are the key properties of [ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate?
[ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate has a molecular weight of 296.20 g/mol, XLogP of 1.99, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [ethenyl-methyl-(2,2,2-trifluoroacetyl)oxysilyl] 2,2,2-trifluoroacetate is sourced from PubChem (CID 15864568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).