ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane

C9H15F7OSi — CID 59112366

IUPACethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane
SMILESCCO[Si](C)(C)CCC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C9H15F7OSi/c1-4-17-18(2,3)6-5-7(10,11)8(12,13)9(14,15)16/h4-6H2,1-3H3
InChIKeyKZIVHKUKVJAACW-UHFFFAOYSA-N
MW300.29 g/mol
LogP4.45
Rot. Bonds6

About ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane

ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane (PubChem CID 59112366) has the molecular formula C9H15F7OSi and a molecular weight of 300.29 g/mol. Its IUPAC name is ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane.

Molecular Properties

Compound Nameethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane
PubChem CID59112366
Molecular FormulaC9H15F7OSi
Molecular Weight300.29 g/mol
Exact Mass300.08
IUPAC Nameethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane
SMILESCCO[Si](C)(C)CCC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C9H15F7OSi/c1-4-17-18(2,3)6-5-7(10,11)8(12,13)9(14,15)16/h4-6H2,1-3H3
InChIKeyKZIVHKUKVJAACW-UHFFFAOYSA-N
XLogP4.45
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.29
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

Ethoxydimethyl((perfluorohexyl)ethyl)silane
CID 18448867
(3,3,4,4,5,5,5-Heptafluoropentyl)(trimethoxy)silane
CID 52991970
Methoxydimethyl(3,3,4,4,4-pentafluorobutyl)silane
CID 53925649
Methoxydipropyl(3,3,4,4,5,5,6,6,6-nonafluorohexyl)silane
CID 59112300
Methoxydimethyl(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane
CID 59112301
Methoxydimethyl(3,3,4,4,5,5,5-heptafluoropentyl)silane
CID 59112304
Diethylmethoxy(3,3,4,4,5,5,5-heptafluoropentyl)silane
CID 59112306
Methoxy (3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl) bis(3,3,3-trifluoropropyl) silane
CID 59112314
Ethoxydimethyl (3,3,4,4,5,5,6,6,6-nonafluorohexyl) silane
CID 59112321
Diethylmethoxy(3,3,4,4,4-pentafluorobutyl)silane
CID 59112323
Ethoxydimethyl (3,3,4,4,4-pentafluorobutyl) silane
CID 59112324
Methoxy (3,3,4,4,5,5,6,6,6-nonafluorohexyl) bis(3,3,3-trifluoropropyl) silane
CID 59112326

Frequently Asked Questions

What is the IUPAC name of ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane?
The IUPAC name of ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane (CID 59112366) is ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane.
What is the SMILES notation for ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane?
The canonical SMILES for ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane is CCO[Si](C)(C)CCC(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane?
The InChIKey is KZIVHKUKVJAACW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F7OSi/c1-4-17-18(2,3)6-5-7(10,11)8(12,13)9(14,15)16/h4-6H2,1-3H3.
What are the key properties of ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane?
ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane has a molecular weight of 300.29 g/mol, XLogP of 4.45, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane is sourced from PubChem (CID 59112366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).