triphenyl-(2-triphenylsilyloxyphenoxy)silane

C42H34O2Si2 — CID 154164167

IUPACtriphenyl-(2-triphenylsilyloxyphenoxy)silane
SMILESc1ccc([Si](Oc2ccccc2O[Si](c2ccccc2)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C42H34O2Si2/c1-7-21-35(22-8-1)45(36-23-9-2-10-24-36,37-25-11-3-12-26-37)43-41-33-19-20-34-42(41)44-46(38-27-13-4-14-28-38,39-29-15-5-16-30-39)40-31-17-6-18-32-40/h1-34H
InChIKeyVFQMZYVRJGUGIS-UHFFFAOYSA-N
MW626.90 g/mol
LogP5.78
Rot. Bonds10

About triphenyl-(2-triphenylsilyloxyphenoxy)silane

triphenyl-(2-triphenylsilyloxyphenoxy)silane (PubChem CID 154164167) has the molecular formula C42H34O2Si2 and a molecular weight of 626.90 g/mol. Its IUPAC name is triphenyl-(2-triphenylsilyloxyphenoxy)silane.

Molecular Properties

Compound Nametriphenyl-(2-triphenylsilyloxyphenoxy)silane
PubChem CID154164167
Molecular FormulaC42H34O2Si2
Molecular Weight626.90 g/mol
Exact Mass626.21
IUPAC Nametriphenyl-(2-triphenylsilyloxyphenoxy)silane
SMILESc1ccc([Si](Oc2ccccc2O[Si](c2ccccc2)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C42H34O2Si2/c1-7-21-35(22-8-1)45(36-23-9-2-10-24-36,37-25-11-3-12-26-37)43-41-33-19-20-34-42(41)44-46(38-27-13-4-14-28-38,39-29-15-5-16-30-39)40-31-17-6-18-32-40/h1-34H
InChIKeyVFQMZYVRJGUGIS-UHFFFAOYSA-N
XLogP5.78
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms46
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500626.90
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triphenyl-(2-triphenylsilyloxyphenoxy)silane?
The IUPAC name of triphenyl-(2-triphenylsilyloxyphenoxy)silane (CID 154164167) is triphenyl-(2-triphenylsilyloxyphenoxy)silane.
What is the SMILES notation for triphenyl-(2-triphenylsilyloxyphenoxy)silane?
The canonical SMILES for triphenyl-(2-triphenylsilyloxyphenoxy)silane is c1ccc([Si](Oc2ccccc2O[Si](c2ccccc2)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of triphenyl-(2-triphenylsilyloxyphenoxy)silane?
The InChIKey is VFQMZYVRJGUGIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H34O2Si2/c1-7-21-35(22-8-1)45(36-23-9-2-10-24-36,37-25-11-3-12-26-37)43-41-33-19-20-34-42(41)44-46(38-27-13-4-14-28-38,39-29-15-5-16-30-39)40-31-17-6-18-32-40/h1-34H.
What are the key properties of triphenyl-(2-triphenylsilyloxyphenoxy)silane?
triphenyl-(2-triphenylsilyloxyphenoxy)silane has a molecular weight of 626.90 g/mol, XLogP of 5.78, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-(2-triphenylsilyloxyphenoxy)silane is sourced from PubChem (CID 154164167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).