tributyl(tert-butylperoxy)silane

C16H36O2Si — CID 134995750

IUPACtributyl(tert-butylperoxy)silane
SMILESCCCC[Si](CCCC)(CCCC)OOC(C)(C)C
InChIInChI=1S/C16H36O2Si/c1-7-10-13-19(14-11-8-2,15-12-9-3)18-17-16(4,5)6/h7-15H2,1-6H3
InChIKeyIDUVZGRYYIQCCB-UHFFFAOYSA-N
MW288.55 g/mol
LogP6.08
Rot. Bonds11

About tributyl(tert-butylperoxy)silane

tributyl(tert-butylperoxy)silane (PubChem CID 134995750) has the molecular formula C16H36O2Si and a molecular weight of 288.55 g/mol. Its IUPAC name is tributyl(tert-butylperoxy)silane.

Molecular Properties

Compound Nametributyl(tert-butylperoxy)silane
PubChem CID134995750
Molecular FormulaC16H36O2Si
Molecular Weight288.55 g/mol
Exact Mass288.25
IUPAC Nametributyl(tert-butylperoxy)silane
SMILESCCCC[Si](CCCC)(CCCC)OOC(C)(C)C
InChIInChI=1S/C16H36O2Si/c1-7-10-13-19(14-11-8-2,15-12-9-3)18-17-16(4,5)6/h7-15H2,1-6H3
InChIKeyIDUVZGRYYIQCCB-UHFFFAOYSA-N
XLogP6.08
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.55
LogP ≤ 56.08
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'}

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Related Compounds

Trimethylsilyl tert-butyl peroxide
CID 77585
Bis(1,1-dimethylethoxy)dimethylsilane
CID 87280
t-Butoxy-t-butyl-dimethylsilane
CID 11805498
Diethyl-bis-tert-butylperoxy-silane
CID 20191492
Bis((1,1-dimethylethyl)dioxy)dimethylsilane
CID 12585037
Triethyl-t-butylperoxy silicon
CID 15388313
Trimethyl-1,1-dimethylpropylperoxy-silane
CID 20520045
Ethyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane
CID 22886664
(tert-Butylperoxy)(chloro)diethylsilane
CID 12426016
t-Butylperoxypentamethyldisiloxane
CID 12499919
Tris(trimethylsiloxy)t-butylperoxysilane
CID 12499922
Triethyl-[(2-methylpropan-2-yl)oxy]silane
CID 12772184

Frequently Asked Questions

What is the IUPAC name of tributyl(tert-butylperoxy)silane?
The IUPAC name of tributyl(tert-butylperoxy)silane (CID 134995750) is tributyl(tert-butylperoxy)silane.
What is the SMILES notation for tributyl(tert-butylperoxy)silane?
The canonical SMILES for tributyl(tert-butylperoxy)silane is CCCC[Si](CCCC)(CCCC)OOC(C)(C)C.
What is the InChIKey of tributyl(tert-butylperoxy)silane?
The InChIKey is IDUVZGRYYIQCCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O2Si/c1-7-10-13-19(14-11-8-2,15-12-9-3)18-17-16(4,5)6/h7-15H2,1-6H3.
What are the key properties of tributyl(tert-butylperoxy)silane?
tributyl(tert-butylperoxy)silane has a molecular weight of 288.55 g/mol, XLogP of 6.08, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(tert-butylperoxy)silane is sourced from PubChem (CID 134995750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).