tert-butylperoxy(triphenyl)silane

C22H24O2Si — CID 15606852

IUPACtert-butylperoxy(triphenyl)silane
SMILESCC(C)(C)OO[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H24O2Si/c1-22(2,3)23-24-25(19-13-7-4-8-14-19,20-15-9-5-10-16-20)21-17-11-6-12-18-21/h4-18H,1-3H3
InChIKeyBJDCYOLBAMFSMI-UHFFFAOYSA-N
MW348.52 g/mol
LogP3.40
Rot. Bonds5

About tert-butylperoxy(triphenyl)silane

tert-butylperoxy(triphenyl)silane (PubChem CID 15606852) has the molecular formula C22H24O2Si and a molecular weight of 348.52 g/mol. Its IUPAC name is tert-butylperoxy(triphenyl)silane.

Molecular Properties

Compound Nametert-butylperoxy(triphenyl)silane
PubChem CID15606852
Molecular FormulaC22H24O2Si
Molecular Weight348.52 g/mol
Exact Mass348.15
IUPAC Nametert-butylperoxy(triphenyl)silane
SMILESCC(C)(C)OO[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H24O2Si/c1-22(2,3)23-24-25(19-13-7-4-8-14-19,20-15-9-5-10-16-20)21-17-11-6-12-18-21/h4-18H,1-3H3
InChIKeyBJDCYOLBAMFSMI-UHFFFAOYSA-N
XLogP3.40
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.52
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butylperoxy(triphenyl)silane?
The IUPAC name of tert-butylperoxy(triphenyl)silane (CID 15606852) is tert-butylperoxy(triphenyl)silane.
What is the SMILES notation for tert-butylperoxy(triphenyl)silane?
The canonical SMILES for tert-butylperoxy(triphenyl)silane is CC(C)(C)OO[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of tert-butylperoxy(triphenyl)silane?
The InChIKey is BJDCYOLBAMFSMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24O2Si/c1-22(2,3)23-24-25(19-13-7-4-8-14-19,20-15-9-5-10-16-20)21-17-11-6-12-18-21/h4-18H,1-3H3.
What are the key properties of tert-butylperoxy(triphenyl)silane?
tert-butylperoxy(triphenyl)silane has a molecular weight of 348.52 g/mol, XLogP of 3.40, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butylperoxy(triphenyl)silane is sourced from PubChem (CID 15606852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).