diethoxy-ethyl-propoxysilane

C9H22O3Si — CID 22211908

IUPACdiethoxy-ethyl-propoxysilane
SMILESCCCO[Si](CC)(OCC)OCC
InChIInChI=1S/C9H22O3Si/c1-5-9-12-13(8-4,10-6-2)11-7-3/h5-9H2,1-4H3
InChIKeyZZFSNGXORXAXCS-UHFFFAOYSA-N
MW206.36 g/mol
LogP2.44
Rot. Bonds8

About diethoxy-ethyl-propoxysilane

diethoxy-ethyl-propoxysilane (PubChem CID 22211908) has the molecular formula C9H22O3Si and a molecular weight of 206.36 g/mol. Its IUPAC name is diethoxy-ethyl-propoxysilane.

Molecular Properties

Compound Namediethoxy-ethyl-propoxysilane
PubChem CID22211908
Molecular FormulaC9H22O3Si
Molecular Weight206.36 g/mol
Exact Mass206.13
IUPAC Namediethoxy-ethyl-propoxysilane
SMILESCCCO[Si](CC)(OCC)OCC
InChIInChI=1S/C9H22O3Si/c1-5-9-12-13(8-4,10-6-2)11-7-3/h5-9H2,1-4H3
InChIKeyZZFSNGXORXAXCS-UHFFFAOYSA-N
XLogP2.44
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.36
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 diethoxy-ethyl-propoxysilane?
The IUPAC name of diethoxy-ethyl-propoxysilane (CID 22211908) is diethoxy-ethyl-propoxysilane.
What is the SMILES notation for diethoxy-ethyl-propoxysilane?
The canonical SMILES for diethoxy-ethyl-propoxysilane is CCCO[Si](CC)(OCC)OCC.
What is the InChIKey of diethoxy-ethyl-propoxysilane?
The InChIKey is ZZFSNGXORXAXCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22O3Si/c1-5-9-12-13(8-4,10-6-2)11-7-3/h5-9H2,1-4H3.
What are the key properties of diethoxy-ethyl-propoxysilane?
diethoxy-ethyl-propoxysilane has a molecular weight of 206.36 g/mol, XLogP of 2.44, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-ethyl-propoxysilane is sourced from PubChem (CID 22211908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).