tris(3-dimethoxysilylpropyl)-methylsilane

C16H42O6Si4 — CID 123689952

IUPACtris(3-dimethoxysilylpropyl)-methylsilane
SMILESCO[SiH](CCC[Si](C)(CCC[SiH](OC)OC)CCC[SiH](OC)OC)OC
InChIInChI=1S/C16H42O6Si4/c1-17-23(18-2)11-8-14-26(7,15-9-12-24(19-3)20-4)16-10-13-25(21-5)22-6/h23-25H,8-16H2,1-7H3
InChIKeyXKWISJQNLFGBFI-UHFFFAOYSA-N
MW442.85 g/mol
LogP2.78
Rot. Bonds18

About tris(3-dimethoxysilylpropyl)-methylsilane

tris(3-dimethoxysilylpropyl)-methylsilane (PubChem CID 123689952) has the molecular formula C16H42O6Si4 and a molecular weight of 442.85 g/mol. Its IUPAC name is tris(3-dimethoxysilylpropyl)-methylsilane.

Molecular Properties

Compound Nametris(3-dimethoxysilylpropyl)-methylsilane
PubChem CID123689952
Molecular FormulaC16H42O6Si4
Molecular Weight442.85 g/mol
Exact Mass442.21
IUPAC Nametris(3-dimethoxysilylpropyl)-methylsilane
SMILESCO[SiH](CCC[Si](C)(CCC[SiH](OC)OC)CCC[SiH](OC)OC)OC
InChIInChI=1S/C16H42O6Si4/c1-17-23(18-2)11-8-14-26(7,15-9-12-24(19-3)20-4)16-10-13-25(21-5)22-6/h23-25H,8-16H2,1-7H3
InChIKeyXKWISJQNLFGBFI-UHFFFAOYSA-N
XLogP2.78
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds18
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.85
LogP ≤ 52.78
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 tris(3-dimethoxysilylpropyl)-methylsilane?
The IUPAC name of tris(3-dimethoxysilylpropyl)-methylsilane (CID 123689952) is tris(3-dimethoxysilylpropyl)-methylsilane.
What is the SMILES notation for tris(3-dimethoxysilylpropyl)-methylsilane?
The canonical SMILES for tris(3-dimethoxysilylpropyl)-methylsilane is CO[SiH](CCC[Si](C)(CCC[SiH](OC)OC)CCC[SiH](OC)OC)OC.
What is the InChIKey of tris(3-dimethoxysilylpropyl)-methylsilane?
The InChIKey is XKWISJQNLFGBFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H42O6Si4/c1-17-23(18-2)11-8-14-26(7,15-9-12-24(19-3)20-4)16-10-13-25(21-5)22-6/h23-25H,8-16H2,1-7H3.
What are the key properties of tris(3-dimethoxysilylpropyl)-methylsilane?
tris(3-dimethoxysilylpropyl)-methylsilane has a molecular weight of 442.85 g/mol, XLogP of 2.78, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tris(3-dimethoxysilylpropyl)-methylsilane is sourced from PubChem (CID 123689952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).