ethoxy(trioxido)silane

C2H5O4Si-3 — CID 53442617

IUPACethoxy(trioxido)silane
SMILESCCO[Si]([O-])([O-])[O-]
InChIInChI=1S/C2H5O4Si/c1-2-6-7(3,4)5/h2H2,1H3/q-3
InChIKeyLJFWUWYDTLNYHZ-UHFFFAOYSA-N
MW121.14 g/mol
LogP-3.46
Rot. Bonds2

About ethoxy(trioxido)silane

ethoxy(trioxido)silane (PubChem CID 53442617) has the molecular formula C2H5O4Si-3 and a molecular weight of 121.14 g/mol. Its IUPAC name is ethoxy(trioxido)silane.

Molecular Properties

Compound Nameethoxy(trioxido)silane
PubChem CID53442617
Molecular FormulaC2H5O4Si-3
Molecular Weight121.14 g/mol
Exact Mass121.00
IUPAC Nameethoxy(trioxido)silane
SMILESCCO[Si]([O-])([O-])[O-]
InChIInChI=1S/C2H5O4Si/c1-2-6-7(3,4)5/h2H2,1H3/q-3
InChIKeyLJFWUWYDTLNYHZ-UHFFFAOYSA-N
XLogP-3.46
TPSA78.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.14
LogP ≤ 5-3.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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(trioxido)silane?
The IUPAC name of ethoxy(trioxido)silane (CID 53442617) is ethoxy(trioxido)silane.
What is the SMILES notation for ethoxy(trioxido)silane?
The canonical SMILES for ethoxy(trioxido)silane is CCO[Si]([O-])([O-])[O-].
What is the InChIKey of ethoxy(trioxido)silane?
The InChIKey is LJFWUWYDTLNYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5O4Si/c1-2-6-7(3,4)5/h2H2,1H3/q-3.
What are the key properties of ethoxy(trioxido)silane?
ethoxy(trioxido)silane has a molecular weight of 121.14 g/mol, XLogP of -3.46, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy(trioxido)silane is sourced from PubChem (CID 53442617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).