trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane

C9H13F3OSSi — CID 101068482

IUPACtrimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane
SMILESC[Si](C)(C)OC(c1ccsc1)C(F)(F)F
InChIInChI=1S/C9H13F3OSSi/c1-15(2,3)13-8(9(10,11)12)7-4-5-14-6-7/h4-6,8H,1-3H3
InChIKeyQTUPLEVLXFMFID-UHFFFAOYSA-N
MW254.35 g/mol
LogP4.20
Rot. Bonds3

About trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane

trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane (PubChem CID 101068482) has the molecular formula C9H13F3OSSi and a molecular weight of 254.35 g/mol. Its IUPAC name is trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane.

Molecular Properties

Compound Nametrimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane
PubChem CID101068482
Molecular FormulaC9H13F3OSSi
Molecular Weight254.35 g/mol
Exact Mass254.04
IUPAC Nametrimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane
SMILESC[Si](C)(C)OC(c1ccsc1)C(F)(F)F
InChIInChI=1S/C9H13F3OSSi/c1-15(2,3)13-8(9(10,11)12)7-4-5-14-6-7/h4-6,8H,1-3H3
InChIKeyQTUPLEVLXFMFID-UHFFFAOYSA-N
XLogP4.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane?
The IUPAC name of trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane (CID 101068482) is trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane.
What is the SMILES notation for trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane?
The canonical SMILES for trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane is C[Si](C)(C)OC(c1ccsc1)C(F)(F)F.
What is the InChIKey of trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane?
The InChIKey is QTUPLEVLXFMFID-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13F3OSSi/c1-15(2,3)13-8(9(10,11)12)7-4-5-14-6-7/h4-6,8H,1-3H3.
What are the key properties of trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane?
trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane has a molecular weight of 254.35 g/mol, XLogP of 4.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(2,2,2-trifluoro-1-thiophen-3-ylethoxy)silane is sourced from PubChem (CID 101068482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).