triethoxy-(4-triethoxysilylphenyl)silane

C18H34O6Si2 — CID 11495075

IUPACtriethoxy-(4-triethoxysilylphenyl)silane
SMILESCCO[Si](OCC)(OCC)c1ccc([Si](OCC)(OCC)OCC)cc1
InChIInChI=1S/C18H34O6Si2/c1-7-19-25(20-8-2,21-9-3)17-13-15-18(16-14-17)26(22-10-4,23-11-5)24-12-6/h13-16H,7-12H2,1-6H3
InChIKeyYYJNCOSWWOMZHX-UHFFFAOYSA-N
MW402.64 g/mol
LogP2.20
Rot. Bonds14

About triethoxy-(4-triethoxysilylphenyl)silane

triethoxy-(4-triethoxysilylphenyl)silane (PubChem CID 11495075) has the molecular formula C18H34O6Si2 and a molecular weight of 402.64 g/mol. Its IUPAC name is triethoxy-(4-triethoxysilylphenyl)silane.

Molecular Properties

Compound Nametriethoxy-(4-triethoxysilylphenyl)silane
PubChem CID11495075
Molecular FormulaC18H34O6Si2
Molecular Weight402.64 g/mol
Exact Mass402.19
IUPAC Nametriethoxy-(4-triethoxysilylphenyl)silane
SMILESCCO[Si](OCC)(OCC)c1ccc([Si](OCC)(OCC)OCC)cc1
InChIInChI=1S/C18H34O6Si2/c1-7-19-25(20-8-2,21-9-3)17-13-15-18(16-14-17)26(22-10-4,23-11-5)24-12-6/h13-16H,7-12H2,1-6H3
InChIKeyYYJNCOSWWOMZHX-UHFFFAOYSA-N
XLogP2.20
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.64
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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 triethoxy-(4-triethoxysilylphenyl)silane?
The IUPAC name of triethoxy-(4-triethoxysilylphenyl)silane (CID 11495075) is triethoxy-(4-triethoxysilylphenyl)silane.
What is the SMILES notation for triethoxy-(4-triethoxysilylphenyl)silane?
The canonical SMILES for triethoxy-(4-triethoxysilylphenyl)silane is CCO[Si](OCC)(OCC)c1ccc([Si](OCC)(OCC)OCC)cc1.
What is the InChIKey of triethoxy-(4-triethoxysilylphenyl)silane?
The InChIKey is YYJNCOSWWOMZHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O6Si2/c1-7-19-25(20-8-2,21-9-3)17-13-15-18(16-14-17)26(22-10-4,23-11-5)24-12-6/h13-16H,7-12H2,1-6H3.
What are the key properties of triethoxy-(4-triethoxysilylphenyl)silane?
triethoxy-(4-triethoxysilylphenyl)silane has a molecular weight of 402.64 g/mol, XLogP of 2.20, 14 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-(4-triethoxysilylphenyl)silane is sourced from PubChem (CID 11495075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).