tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate

C16H46O7Si6 — CID 123949735

IUPACtris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate
SMILESCCO[Si](CC[Si](C)(C)O[Si](O[SiH](C)C)(O[SiH](C)C)O[SiH](C)C)(OCC)OCC
InChIInChI=1S/C16H46O7Si6/c1-12-17-28(18-13-2,19-14-3)16-15-27(10,11)23-29(20-24(4)5,21-25(6)7)22-26(8)9/h24-26H,12-16H2,1-11H3
InChIKeyURHHDRYJGQRDTO-UHFFFAOYSA-N
MW519.05 g/mol
LogP3.69
Rot. Bonds17

About tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate

tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate (PubChem CID 123949735) has the molecular formula C16H46O7Si6 and a molecular weight of 519.05 g/mol. Its IUPAC name is tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate.

Molecular Properties

Compound Nametris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate
PubChem CID123949735
Molecular FormulaC16H46O7Si6
Molecular Weight519.05 g/mol
Exact Mass518.19
IUPAC Nametris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate
SMILESCCO[Si](CC[Si](C)(C)O[Si](O[SiH](C)C)(O[SiH](C)C)O[SiH](C)C)(OCC)OCC
InChIInChI=1S/C16H46O7Si6/c1-12-17-28(18-13-2,19-14-3)16-15-27(10,11)23-29(20-24(4)5,21-25(6)7)22-26(8)9/h24-26H,12-16H2,1-11H3
InChIKeyURHHDRYJGQRDTO-UHFFFAOYSA-N
XLogP3.69
TPSA64.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds17
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500519.05
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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 tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate?
The IUPAC name of tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate (CID 123949735) is tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate.
What is the SMILES notation for tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate?
The canonical SMILES for tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate is CCO[Si](CC[Si](C)(C)O[Si](O[SiH](C)C)(O[SiH](C)C)O[SiH](C)C)(OCC)OCC.
What is the InChIKey of tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate?
The InChIKey is URHHDRYJGQRDTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H46O7Si6/c1-12-17-28(18-13-2,19-14-3)16-15-27(10,11)23-29(20-24(4)5,21-25(6)7)22-26(8)9/h24-26H,12-16H2,1-11H3.
What are the key properties of tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate?
tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate has a molecular weight of 519.05 g/mol, XLogP of 3.69, 17 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for tris(dimethylsilyl) [dimethyl(2-triethoxysilylethyl)silyl] silicate is sourced from PubChem (CID 123949735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).