3,3-diethoxypropyl-(4-ethenylphenoxy)silane

C15H24O3Si — CID 154372548

IUPAC3,3-diethoxypropyl-(4-ethenylphenoxy)silane
SMILESC=Cc1ccc(O[SiH2]CCC(OCC)OCC)cc1
InChIInChI=1S/C15H24O3Si/c1-4-13-7-9-14(10-8-13)18-19-12-11-15(16-5-2)17-6-3/h4,7-10,15H,1,5-6,11-12,19H2,2-3H3
InChIKeyQQBSSYWSTUPYCO-UHFFFAOYSA-N
MW280.44 g/mol
LogP3.00
Rot. Bonds10

About 3,3-diethoxypropyl-(4-ethenylphenoxy)silane

3,3-diethoxypropyl-(4-ethenylphenoxy)silane (PubChem CID 154372548) has the molecular formula C15H24O3Si and a molecular weight of 280.44 g/mol. Its IUPAC name is 3,3-diethoxypropyl-(4-ethenylphenoxy)silane.

Molecular Properties

Compound Name3,3-diethoxypropyl-(4-ethenylphenoxy)silane
PubChem CID154372548
Molecular FormulaC15H24O3Si
Molecular Weight280.44 g/mol
Exact Mass280.15
IUPAC Name3,3-diethoxypropyl-(4-ethenylphenoxy)silane
SMILESC=Cc1ccc(O[SiH2]CCC(OCC)OCC)cc1
InChIInChI=1S/C15H24O3Si/c1-4-13-7-9-14(10-8-13)18-19-12-11-15(16-5-2)17-6-3/h4,7-10,15H,1,5-6,11-12,19H2,2-3H3
InChIKeyQQBSSYWSTUPYCO-UHFFFAOYSA-N
XLogP3.00
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 3,3-diethoxypropyl-(4-ethenylphenoxy)silane?
The IUPAC name of 3,3-diethoxypropyl-(4-ethenylphenoxy)silane (CID 154372548) is 3,3-diethoxypropyl-(4-ethenylphenoxy)silane.
What is the SMILES notation for 3,3-diethoxypropyl-(4-ethenylphenoxy)silane?
The canonical SMILES for 3,3-diethoxypropyl-(4-ethenylphenoxy)silane is C=Cc1ccc(O[SiH2]CCC(OCC)OCC)cc1.
What is the InChIKey of 3,3-diethoxypropyl-(4-ethenylphenoxy)silane?
The InChIKey is QQBSSYWSTUPYCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O3Si/c1-4-13-7-9-14(10-8-13)18-19-12-11-15(16-5-2)17-6-3/h4,7-10,15H,1,5-6,11-12,19H2,2-3H3.
What are the key properties of 3,3-diethoxypropyl-(4-ethenylphenoxy)silane?
3,3-diethoxypropyl-(4-ethenylphenoxy)silane has a molecular weight of 280.44 g/mol, XLogP of 3.00, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diethoxypropyl-(4-ethenylphenoxy)silane is sourced from PubChem (CID 154372548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).