triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane

C9H15F7O3Si — CID 22608749

IUPACtriethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane
SMILESCCO[Si](OCC)(OCC)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C9H15F7O3Si/c1-4-17-20(18-5-2,19-6-3)9(15,16)7(10,11)8(12,13)14/h4-6H2,1-3H3
InChIKeyAYXPXUKKHKSVGX-UHFFFAOYSA-N
MW332.29 g/mol
LogP3.41
Rot. Bonds8

About triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane

triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane (PubChem CID 22608749) has the molecular formula C9H15F7O3Si and a molecular weight of 332.29 g/mol. Its IUPAC name is triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane.

Molecular Properties

Compound Nametriethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane
PubChem CID22608749
Molecular FormulaC9H15F7O3Si
Molecular Weight332.29 g/mol
Exact Mass332.07
IUPAC Nametriethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane
SMILESCCO[Si](OCC)(OCC)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C9H15F7O3Si/c1-4-17-20(18-5-2,19-6-3)9(15,16)7(10,11)8(12,13)14/h4-6H2,1-3H3
InChIKeyAYXPXUKKHKSVGX-UHFFFAOYSA-N
XLogP3.41
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.29
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Triethoxy(3,3,3-trifluoropropyl)silane
CID 13222391
[3-(Heptafluoropropoxy)propyl](trimethoxy)silane
CID 2733757
Perfluorooctyltriethoxysilane
CID 11657151
(3,3,4,4,5,5,5-Heptafluoropentyl)(trimethoxy)silane
CID 52991970
Triethoxy(1,1,2,2,3,3,6,6,6-nonafluorohexyl)silane
CID 53437828
Ethoxydimethyl (3,3,4,4,4-pentafluorobutyl) silane
CID 59112324
Ethoxydimethyl (3,3,4,4,5,5,5-heptafluoropentyl) silane
CID 59112366
Diethoxy(methyl)(3,3,3-trifluoropropyl)silane
CID 14007317
Pentafluoroethyltriethoxysilane
CID 22608748
Trimethoxy(1,1,2,2,3,3,4,4,5-nonafluorohexyl)silane
CID 53905050
Triethoxy(1,1,2,2,3,3,4,4,5-nonafluorohexyl)silane
CID 53983955
Ethoxy-ethyl-(1-fluoroethoxy)-(1,1,2,2,2-pentafluoroethoxy)silane
CID 123733289

Frequently Asked Questions

What is the IUPAC name of triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane?
The IUPAC name of triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane (CID 22608749) is triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane.
What is the SMILES notation for triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane?
The canonical SMILES for triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane is CCO[Si](OCC)(OCC)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane?
The InChIKey is AYXPXUKKHKSVGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F7O3Si/c1-4-17-20(18-5-2,19-6-3)9(15,16)7(10,11)8(12,13)14/h4-6H2,1-3H3.
What are the key properties of triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane?
triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane has a molecular weight of 332.29 g/mol, XLogP of 3.41, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane is sourced from PubChem (CID 22608749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).