diethoxy(ethynoxy)silane

C6H12O3Si — CID 58807018

IUPACdiethoxy(ethynoxy)silane
SMILESC#CO[SiH](OCC)OCC
InChIInChI=1S/C6H12O3Si/c1-4-7-10(8-5-2)9-6-3/h1,10H,5-6H2,2-3H3
InChIKeyDZBSTFLSIWQTLL-UHFFFAOYSA-N
MW160.25 g/mol
LogP0.38
Rot. Bonds5

About diethoxy(ethynoxy)silane

diethoxy(ethynoxy)silane (PubChem CID 58807018) has the molecular formula C6H12O3Si and a molecular weight of 160.25 g/mol. Its IUPAC name is diethoxy(ethynoxy)silane.

Molecular Properties

Compound Namediethoxy(ethynoxy)silane
PubChem CID58807018
Molecular FormulaC6H12O3Si
Molecular Weight160.25 g/mol
Exact Mass160.06
IUPAC Namediethoxy(ethynoxy)silane
SMILESC#CO[SiH](OCC)OCC
InChIInChI=1S/C6H12O3Si/c1-4-7-10(8-5-2)9-6-3/h1,10H,5-6H2,2-3H3
InChIKeyDZBSTFLSIWQTLL-UHFFFAOYSA-N
XLogP0.38
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.25
LogP ≤ 50.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diethoxy(ethynoxy)silane?
The IUPAC name of diethoxy(ethynoxy)silane (CID 58807018) is diethoxy(ethynoxy)silane.
What is the SMILES notation for diethoxy(ethynoxy)silane?
The canonical SMILES for diethoxy(ethynoxy)silane is C#CO[SiH](OCC)OCC.
What is the InChIKey of diethoxy(ethynoxy)silane?
The InChIKey is DZBSTFLSIWQTLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O3Si/c1-4-7-10(8-5-2)9-6-3/h1,10H,5-6H2,2-3H3.
What are the key properties of diethoxy(ethynoxy)silane?
diethoxy(ethynoxy)silane has a molecular weight of 160.25 g/mol, XLogP of 0.38, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy(ethynoxy)silane is sourced from PubChem (CID 58807018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).