ethanol;ethoxy-hydroxy-oxosilane

C4H12O4Si — CID 87450344

IUPACethanol;ethoxy-hydroxy-oxosilane
SMILESCCO.CCO[Si](=O)O
InChIInChI=1S/C2H6O3Si.C2H6O/c1-2-5-6(3)4;1-2-3/h3H,2H2,1H3;3H,2H2,1H3
InChIKeyRWAPGOSJOZJQPJ-UHFFFAOYSA-N
MW152.22 g/mol
LogP-0.57
Rot. Bonds2

About ethanol;ethoxy-hydroxy-oxosilane

ethanol;ethoxy-hydroxy-oxosilane (PubChem CID 87450344) has the molecular formula C4H12O4Si and a molecular weight of 152.22 g/mol. Its IUPAC name is ethanol;ethoxy-hydroxy-oxosilane.

Molecular Properties

Compound Nameethanol;ethoxy-hydroxy-oxosilane
PubChem CID87450344
Molecular FormulaC4H12O4Si
Molecular Weight152.22 g/mol
Exact Mass152.05
IUPAC Nameethanol;ethoxy-hydroxy-oxosilane
SMILESCCO.CCO[Si](=O)O
InChIInChI=1S/C2H6O3Si.C2H6O/c1-2-5-6(3)4;1-2-3/h3H,2H2,1H3;3H,2H2,1H3
InChIKeyRWAPGOSJOZJQPJ-UHFFFAOYSA-N
XLogP-0.57
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.22
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze ethanol;ethoxy-hydroxy-oxosilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethanol;ethoxy-hydroxy-oxosilane?
The IUPAC name of ethanol;ethoxy-hydroxy-oxosilane (CID 87450344) is ethanol;ethoxy-hydroxy-oxosilane.
What is the SMILES notation for ethanol;ethoxy-hydroxy-oxosilane?
The canonical SMILES for ethanol;ethoxy-hydroxy-oxosilane is CCO.CCO[Si](=O)O.
What is the InChIKey of ethanol;ethoxy-hydroxy-oxosilane?
The InChIKey is RWAPGOSJOZJQPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O3Si.C2H6O/c1-2-5-6(3)4;1-2-3/h3H,2H2,1H3;3H,2H2,1H3.
What are the key properties of ethanol;ethoxy-hydroxy-oxosilane?
ethanol;ethoxy-hydroxy-oxosilane has a molecular weight of 152.22 g/mol, XLogP of -0.57, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;ethoxy-hydroxy-oxosilane is sourced from PubChem (CID 87450344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).