(2-ethenylphenyl)methyl-triethoxysilane

C15H24O3Si — CID 67544358

IUPAC(2-ethenylphenyl)methyl-triethoxysilane
SMILESC=Cc1ccccc1C[Si](OCC)(OCC)OCC
InChIInChI=1S/C15H24O3Si/c1-5-14-11-9-10-12-15(14)13-19(16-6-2,17-7-3)18-8-4/h5,9-12H,1,6-8,13H2,2-4H3
InChIKeyLJLVSEBZDFJTEG-UHFFFAOYSA-N
MW280.44 g/mol
LogP3.46
Rot. Bonds9

About (2-ethenylphenyl)methyl-triethoxysilane

(2-ethenylphenyl)methyl-triethoxysilane (PubChem CID 67544358) has the molecular formula C15H24O3Si and a molecular weight of 280.44 g/mol. Its IUPAC name is (2-ethenylphenyl)methyl-triethoxysilane.

Molecular Properties

Compound Name(2-ethenylphenyl)methyl-triethoxysilane
PubChem CID67544358
Molecular FormulaC15H24O3Si
Molecular Weight280.44 g/mol
Exact Mass280.15
IUPAC Name(2-ethenylphenyl)methyl-triethoxysilane
SMILESC=Cc1ccccc1C[Si](OCC)(OCC)OCC
InChIInChI=1S/C15H24O3Si/c1-5-14-11-9-10-12-15(14)13-19(16-6-2,17-7-3)18-8-4/h5,9-12H,1,6-8,13H2,2-4H3
InChIKeyLJLVSEBZDFJTEG-UHFFFAOYSA-N
XLogP3.46
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 (2-ethenylphenyl)methyl-triethoxysilane?
The IUPAC name of (2-ethenylphenyl)methyl-triethoxysilane (CID 67544358) is (2-ethenylphenyl)methyl-triethoxysilane.
What is the SMILES notation for (2-ethenylphenyl)methyl-triethoxysilane?
The canonical SMILES for (2-ethenylphenyl)methyl-triethoxysilane is C=Cc1ccccc1C[Si](OCC)(OCC)OCC.
What is the InChIKey of (2-ethenylphenyl)methyl-triethoxysilane?
The InChIKey is LJLVSEBZDFJTEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O3Si/c1-5-14-11-9-10-12-15(14)13-19(16-6-2,17-7-3)18-8-4/h5,9-12H,1,6-8,13H2,2-4H3.
What are the key properties of (2-ethenylphenyl)methyl-triethoxysilane?
(2-ethenylphenyl)methyl-triethoxysilane has a molecular weight of 280.44 g/mol, XLogP of 3.46, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethenylphenyl)methyl-triethoxysilane is sourced from PubChem (CID 67544358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).