triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane

C10H15F9O3Si — CID 23523574

IUPACtriethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane
SMILESCCO[Si](OCC)(OCC)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H15F9O3Si/c1-4-20-23(21-5-2,22-6-3)10(18,19)8(13,14)7(11,12)9(15,16)17/h4-6H2,1-3H3
InChIKeyAZPLWMMXISHLGB-UHFFFAOYSA-N
MW382.30 g/mol
LogP4.04
Rot. Bonds9

About triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane

triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane (PubChem CID 23523574) has the molecular formula C10H15F9O3Si and a molecular weight of 382.30 g/mol. Its IUPAC name is triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane.

Molecular Properties

Compound Nametriethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane
PubChem CID23523574
Molecular FormulaC10H15F9O3Si
Molecular Weight382.30 g/mol
Exact Mass382.06
IUPAC Nametriethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane
SMILESCCO[Si](OCC)(OCC)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H15F9O3Si/c1-4-20-23(21-5-2,22-6-3)10(18,19)8(13,14)7(11,12)9(15,16)17/h4-6H2,1-3H3
InChIKeyAZPLWMMXISHLGB-UHFFFAOYSA-N
XLogP4.04
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.30
LogP ≤ 54.04
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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Frequently Asked Questions

What is the IUPAC name of triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane?
The IUPAC name of triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane (CID 23523574) is triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane.
What is the SMILES notation for triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane?
The canonical SMILES for triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane is CCO[Si](OCC)(OCC)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane?
The InChIKey is AZPLWMMXISHLGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F9O3Si/c1-4-20-23(21-5-2,22-6-3)10(18,19)8(13,14)7(11,12)9(15,16)17/h4-6H2,1-3H3.
What are the key properties of triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane?
triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane has a molecular weight of 382.30 g/mol, XLogP of 4.04, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane is sourced from PubChem (CID 23523574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).