dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane

C9H15F9O3Si2 — CID 139696293

IUPACdimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane
SMILESC[Si](C)(OCC(F)(F)F)[Si](C)(OCC(F)(F)F)OCC(F)(F)F
InChIInChI=1S/C9H15F9O3Si2/c1-22(2,19-4-7(10,11)12)23(3,20-5-8(13,14)15)21-6-9(16,17)18/h4-6H2,1-3H3
InChIKeySXGWGDFBOWGYFA-UHFFFAOYSA-N
MW398.37 g/mol
LogP4.08
Rot. Bonds7

About dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane

dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane (PubChem CID 139696293) has the molecular formula C9H15F9O3Si2 and a molecular weight of 398.37 g/mol. Its IUPAC name is dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane.

Molecular Properties

Compound Namedimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane
PubChem CID139696293
Molecular FormulaC9H15F9O3Si2
Molecular Weight398.37 g/mol
Exact Mass398.04
IUPAC Namedimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane
SMILESC[Si](C)(OCC(F)(F)F)[Si](C)(OCC(F)(F)F)OCC(F)(F)F
InChIInChI=1S/C9H15F9O3Si2/c1-22(2,19-4-7(10,11)12)23(3,20-5-8(13,14)15)21-6-9(16,17)18/h4-6H2,1-3H3
InChIKeySXGWGDFBOWGYFA-UHFFFAOYSA-N
XLogP4.08
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.37
LogP ≤ 54.08
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 dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane?
The IUPAC name of dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane (CID 139696293) is dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane.
What is the SMILES notation for dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane?
The canonical SMILES for dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane is C[Si](C)(OCC(F)(F)F)[Si](C)(OCC(F)(F)F)OCC(F)(F)F.
What is the InChIKey of dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane?
The InChIKey is SXGWGDFBOWGYFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F9O3Si2/c1-22(2,19-4-7(10,11)12)23(3,20-5-8(13,14)15)21-6-9(16,17)18/h4-6H2,1-3H3.
What are the key properties of dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane?
dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane has a molecular weight of 398.37 g/mol, XLogP of 4.08, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[methyl-bis(2,2,2-trifluoroethoxy)silyl]-(2,2,2-trifluoroethoxy)silane is sourced from PubChem (CID 139696293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).