triethoxy(6,6,6-trifluorohexyl)silane

C12H25F3O3Si — CID 140708883

IUPACtriethoxy(6,6,6-trifluorohexyl)silane
SMILESCCO[Si](CCCCCC(F)(F)F)(OCC)OCC
InChIInChI=1S/C12H25F3O3Si/c1-4-16-19(17-5-2,18-6-3)11-9-7-8-10-12(13,14)15/h4-11H2,1-3H3
InChIKeySDPBYOJISLDJHZ-UHFFFAOYSA-N
MW302.41 g/mol
LogP4.16
Rot. Bonds11

About triethoxy(6,6,6-trifluorohexyl)silane

triethoxy(6,6,6-trifluorohexyl)silane (PubChem CID 140708883) has the molecular formula C12H25F3O3Si and a molecular weight of 302.41 g/mol. Its IUPAC name is triethoxy(6,6,6-trifluorohexyl)silane.

Molecular Properties

Compound Nametriethoxy(6,6,6-trifluorohexyl)silane
PubChem CID140708883
Molecular FormulaC12H25F3O3Si
Molecular Weight302.41 g/mol
Exact Mass302.15
IUPAC Nametriethoxy(6,6,6-trifluorohexyl)silane
SMILESCCO[Si](CCCCCC(F)(F)F)(OCC)OCC
InChIInChI=1S/C12H25F3O3Si/c1-4-16-19(17-5-2,18-6-3)11-9-7-8-10-12(13,14)15/h4-11H2,1-3H3
InChIKeySDPBYOJISLDJHZ-UHFFFAOYSA-N
XLogP4.16
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.41
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethoxy(6,6,6-trifluorohexyl)silane?
The IUPAC name of triethoxy(6,6,6-trifluorohexyl)silane (CID 140708883) is triethoxy(6,6,6-trifluorohexyl)silane.
What is the SMILES notation for triethoxy(6,6,6-trifluorohexyl)silane?
The canonical SMILES for triethoxy(6,6,6-trifluorohexyl)silane is CCO[Si](CCCCCC(F)(F)F)(OCC)OCC.
What is the InChIKey of triethoxy(6,6,6-trifluorohexyl)silane?
The InChIKey is SDPBYOJISLDJHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25F3O3Si/c1-4-16-19(17-5-2,18-6-3)11-9-7-8-10-12(13,14)15/h4-11H2,1-3H3.
What are the key properties of triethoxy(6,6,6-trifluorohexyl)silane?
triethoxy(6,6,6-trifluorohexyl)silane has a molecular weight of 302.41 g/mol, XLogP of 4.16, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(6,6,6-trifluorohexyl)silane is sourced from PubChem (CID 140708883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).