ethoxy(oxo)silane

C2H6O2Si — CID 123594842

IUPACethoxy(oxo)silane
SMILESCCO[SiH]=O
InChIInChI=1S/C2H6O2Si/c1-2-4-5-3/h5H,2H2,1H3
InChIKeyZTPBRPJCWJHYND-UHFFFAOYSA-N
MW90.15 g/mol
LogP-0.28
Rot. Bonds2

About ethoxy(oxo)silane

ethoxy(oxo)silane (PubChem CID 123594842) has the molecular formula C2H6O2Si and a molecular weight of 90.15 g/mol. Its IUPAC name is ethoxy(oxo)silane.

Molecular Properties

Compound Nameethoxy(oxo)silane
PubChem CID123594842
Molecular FormulaC2H6O2Si
Molecular Weight90.15 g/mol
Exact Mass90.01
IUPAC Nameethoxy(oxo)silane
SMILESCCO[SiH]=O
InChIInChI=1S/C2H6O2Si/c1-2-4-5-3/h5H,2H2,1H3
InChIKeyZTPBRPJCWJHYND-UHFFFAOYSA-N
XLogP-0.28
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50090.15
LogP ≤ 5-0.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 ethoxy(oxo)silane?
The IUPAC name of ethoxy(oxo)silane (CID 123594842) is ethoxy(oxo)silane.
What is the SMILES notation for ethoxy(oxo)silane?
The canonical SMILES for ethoxy(oxo)silane is CCO[SiH]=O.
What is the InChIKey of ethoxy(oxo)silane?
The InChIKey is ZTPBRPJCWJHYND-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O2Si/c1-2-4-5-3/h5H,2H2,1H3.
What are the key properties of ethoxy(oxo)silane?
ethoxy(oxo)silane has a molecular weight of 90.15 g/mol, XLogP of -0.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy(oxo)silane is sourced from PubChem (CID 123594842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).