diethoxy(hydroxy)silane

C4H12O3Si — CID 101059867

IUPACdiethoxy(hydroxy)silane
SMILESCCO[SiH](O)OCC
InChIInChI=1S/C4H12O3Si/c1-3-6-8(5)7-4-2/h5,8H,3-4H2,1-2H3
InChIKeyLPOJRVTUGTXUBW-UHFFFAOYSA-N
MW136.22 g/mol
LogP-0.23
Rot. Bonds4

About diethoxy(hydroxy)silane

diethoxy(hydroxy)silane (PubChem CID 101059867) has the molecular formula C4H12O3Si and a molecular weight of 136.22 g/mol. Its IUPAC name is diethoxy(hydroxy)silane.

Molecular Properties

Compound Namediethoxy(hydroxy)silane
PubChem CID101059867
Molecular FormulaC4H12O3Si
Molecular Weight136.22 g/mol
Exact Mass136.06
IUPAC Namediethoxy(hydroxy)silane
SMILESCCO[SiH](O)OCC
InChIInChI=1S/C4H12O3Si/c1-3-6-8(5)7-4-2/h5,8H,3-4H2,1-2H3
InChIKeyLPOJRVTUGTXUBW-UHFFFAOYSA-N
XLogP-0.23
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.22
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
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(hydroxy)silane?
The IUPAC name of diethoxy(hydroxy)silane (CID 101059867) is diethoxy(hydroxy)silane.
What is the SMILES notation for diethoxy(hydroxy)silane?
The canonical SMILES for diethoxy(hydroxy)silane is CCO[SiH](O)OCC.
What is the InChIKey of diethoxy(hydroxy)silane?
The InChIKey is LPOJRVTUGTXUBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12O3Si/c1-3-6-8(5)7-4-2/h5,8H,3-4H2,1-2H3.
What are the key properties of diethoxy(hydroxy)silane?
diethoxy(hydroxy)silane has a molecular weight of 136.22 g/mol, XLogP of -0.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy(hydroxy)silane is sourced from PubChem (CID 101059867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).