dimethyl bis(2,2,2-trifluoroethyl) silicate

C6H10F6O4Si — CID 20697907

IUPACdimethyl bis(2,2,2-trifluoroethyl) silicate
SMILESCO[Si](OC)(OCC(F)(F)F)OCC(F)(F)F
InChIInChI=1S/C6H10F6O4Si/c1-13-17(14-2,15-3-5(7,8)9)16-4-6(10,11)12/h3-4H2,1-2H3
InChIKeySMFLFPKBAQQMLX-UHFFFAOYSA-N
MW288.22 g/mol
LogP1.87
Rot. Bonds6

About dimethyl bis(2,2,2-trifluoroethyl) silicate

dimethyl bis(2,2,2-trifluoroethyl) silicate (PubChem CID 20697907) has the molecular formula C6H10F6O4Si and a molecular weight of 288.22 g/mol. Its IUPAC name is dimethyl bis(2,2,2-trifluoroethyl) silicate.

Molecular Properties

Compound Namedimethyl bis(2,2,2-trifluoroethyl) silicate
PubChem CID20697907
Molecular FormulaC6H10F6O4Si
Molecular Weight288.22 g/mol
Exact Mass288.03
IUPAC Namedimethyl bis(2,2,2-trifluoroethyl) silicate
SMILESCO[Si](OC)(OCC(F)(F)F)OCC(F)(F)F
InChIInChI=1S/C6H10F6O4Si/c1-13-17(14-2,15-3-5(7,8)9)16-4-6(10,11)12/h3-4H2,1-2H3
InChIKeySMFLFPKBAQQMLX-UHFFFAOYSA-N
XLogP1.87
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.22
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 dimethyl bis(2,2,2-trifluoroethyl) silicate?
The IUPAC name of dimethyl bis(2,2,2-trifluoroethyl) silicate (CID 20697907) is dimethyl bis(2,2,2-trifluoroethyl) silicate.
What is the SMILES notation for dimethyl bis(2,2,2-trifluoroethyl) silicate?
The canonical SMILES for dimethyl bis(2,2,2-trifluoroethyl) silicate is CO[Si](OC)(OCC(F)(F)F)OCC(F)(F)F.
What is the InChIKey of dimethyl bis(2,2,2-trifluoroethyl) silicate?
The InChIKey is SMFLFPKBAQQMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F6O4Si/c1-13-17(14-2,15-3-5(7,8)9)16-4-6(10,11)12/h3-4H2,1-2H3.
What are the key properties of dimethyl bis(2,2,2-trifluoroethyl) silicate?
dimethyl bis(2,2,2-trifluoroethyl) silicate has a molecular weight of 288.22 g/mol, XLogP of 1.87, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl bis(2,2,2-trifluoroethyl) silicate is sourced from PubChem (CID 20697907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).