triphenyl-(4-triphenylsilyloxyphenoxy)silane

C42H34O2Si2 — CID 86209033

IUPACtriphenyl-(4-triphenylsilyloxyphenoxy)silane
SMILESc1ccc([Si](Oc2ccc(O[Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C42H34O2Si2/c1-7-19-37(20-8-1)45(38-21-9-2-10-22-38,39-23-11-3-12-24-39)43-35-31-33-36(34-32-35)44-46(40-25-13-4-14-26-40,41-27-15-5-16-28-41)42-29-17-6-18-30-42/h1-34H
InChIKeyWIBZKWAVBAGLMW-UHFFFAOYSA-N
MW626.90 g/mol
LogP5.78
Rot. Bonds10

About triphenyl-(4-triphenylsilyloxyphenoxy)silane

triphenyl-(4-triphenylsilyloxyphenoxy)silane (PubChem CID 86209033) has the molecular formula C42H34O2Si2 and a molecular weight of 626.90 g/mol. Its IUPAC name is triphenyl-(4-triphenylsilyloxyphenoxy)silane.

Molecular Properties

Compound Nametriphenyl-(4-triphenylsilyloxyphenoxy)silane
PubChem CID86209033
Molecular FormulaC42H34O2Si2
Molecular Weight626.90 g/mol
Exact Mass626.21
IUPAC Nametriphenyl-(4-triphenylsilyloxyphenoxy)silane
SMILESc1ccc([Si](Oc2ccc(O[Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C42H34O2Si2/c1-7-19-37(20-8-1)45(38-21-9-2-10-22-38,39-23-11-3-12-24-39)43-35-31-33-36(34-32-35)44-46(40-25-13-4-14-26-40,41-27-15-5-16-28-41)42-29-17-6-18-30-42/h1-34H
InChIKeyWIBZKWAVBAGLMW-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-(4-triphenylsilyloxyphenoxy)silane?
The IUPAC name of triphenyl-(4-triphenylsilyloxyphenoxy)silane (CID 86209033) is triphenyl-(4-triphenylsilyloxyphenoxy)silane.
What is the SMILES notation for triphenyl-(4-triphenylsilyloxyphenoxy)silane?
The canonical SMILES for triphenyl-(4-triphenylsilyloxyphenoxy)silane is c1ccc([Si](Oc2ccc(O[Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of triphenyl-(4-triphenylsilyloxyphenoxy)silane?
The InChIKey is WIBZKWAVBAGLMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H34O2Si2/c1-7-19-37(20-8-1)45(38-21-9-2-10-22-38,39-23-11-3-12-24-39)43-35-31-33-36(34-32-35)44-46(40-25-13-4-14-26-40,41-27-15-5-16-28-41)42-29-17-6-18-30-42/h1-34H.
What are the key properties of triphenyl-(4-triphenylsilyloxyphenoxy)silane?
triphenyl-(4-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-(4-triphenylsilyloxyphenoxy)silane is sourced from PubChem (CID 86209033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).