(Diethoxymethyl)(4-ethenylphenyl)silane

C13H18O2Si — CID 67298366

IUPAC—
SMILESC=Cc1ccc([Si]C(OCC)OCC)cc1
InChIInChI=1S/C13H18O2Si/c1-4-11-7-9-12(10-8-11)16-13(14-5-2)15-6-3/h4,7-10,13H,1,5-6H2,2-3H3
InChIKeyUDSRJBKZGORRKK-UHFFFAOYSA-N
MW234.37 g/mol
LogP2.02
Rot. Bonds7

About (Diethoxymethyl)(4-ethenylphenyl)silane

(Diethoxymethyl)(4-ethenylphenyl)silane (PubChem CID 67298366) has the molecular formula C13H18O2Si and a molecular weight of 234.37 g/mol.

Molecular Properties

Compound Name(Diethoxymethyl)(4-ethenylphenyl)silane
PubChem CID67298366
Molecular FormulaC13H18O2Si
Molecular Weight234.37 g/mol
Exact Mass234.11
IUPAC Name—
SMILESC=Cc1ccc([Si]C(OCC)OCC)cc1
InChIInChI=1S/C13H18O2Si/c1-4-11-7-9-12(10-8-11)16-13(14-5-2)15-6-3/h4,7-10,13H,1,5-6H2,2-3H3
InChIKeyUDSRJBKZGORRKK-UHFFFAOYSA-N
XLogP2.02
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.37
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Diethoxymethyl)(4-ethenylphenyl)silane?
The IUPAC name of (Diethoxymethyl)(4-ethenylphenyl)silane (CID 67298366) is not available.
What is the SMILES notation for (Diethoxymethyl)(4-ethenylphenyl)silane?
The canonical SMILES for (Diethoxymethyl)(4-ethenylphenyl)silane is C=Cc1ccc([Si]C(OCC)OCC)cc1.
What is the InChIKey of (Diethoxymethyl)(4-ethenylphenyl)silane?
The InChIKey is UDSRJBKZGORRKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2Si/c1-4-11-7-9-12(10-8-11)16-13(14-5-2)15-6-3/h4,7-10,13H,1,5-6H2,2-3H3.
What are the key properties of (Diethoxymethyl)(4-ethenylphenyl)silane?
(Diethoxymethyl)(4-ethenylphenyl)silane has a molecular weight of 234.37 g/mol, XLogP of 2.02, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Diethoxymethyl)(4-ethenylphenyl)silane is sourced from PubChem (CID 67298366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).