tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane

C20H46O4Si2 — CID 171490733

IUPACtert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane
SMILESCC(C)(CCC(C)(C)OO[Si](C)(C)C(C)(C)C)OO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H46O4Si2/c1-17(2,3)25(11,12)23-21-19(7,8)15-16-20(9,10)22-24-26(13,14)18(4,5)6/h15-16H2,1-14H3
InChIKeyGIQJCTOPHIPKMG-UHFFFAOYSA-N
MW406.76 g/mol
LogP7.23
Rot. Bonds9

About tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane

tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane (PubChem CID 171490733) has the molecular formula C20H46O4Si2 and a molecular weight of 406.76 g/mol. Its IUPAC name is tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane
PubChem CID171490733
Molecular FormulaC20H46O4Si2
Molecular Weight406.76 g/mol
Exact Mass406.29
IUPAC Nametert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane
SMILESCC(C)(CCC(C)(C)OO[Si](C)(C)C(C)(C)C)OO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H46O4Si2/c1-17(2,3)25(11,12)23-21-19(7,8)15-16-20(9,10)22-24-26(13,14)18(4,5)6/h15-16H2,1-14H3
InChIKeyGIQJCTOPHIPKMG-UHFFFAOYSA-N
XLogP7.23
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.76
LogP ≤ 57.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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'}

Analyze tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl-(chloromethoxy)-dimethylsilane
CID 14145745
CID 89232701
CID 89232701
2-methyl-2-(2-methylpentan-2-ylperoxy)pentane
CID 10910592
tert-butyl-(4,4-dimethylpentoxy)-dimethylsilane
CID 59819312
tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexoxy]-dimethylsilane
CID 6430202
tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxypentoxy]-dimethylsilane
CID 529127
tert-butyl-[10-[tert-butyl(dimethyl)silyl]oxydecoxy]-dimethylsilane
CID 6430197
2,5-dimethoxy-2,5-dimethylhexane
CID 552009
7-[tert-butyl(dimethyl)silyl]oxy-5,5-dimethylheptan-1-ol
CID 21261679
tert-butyl-(2,2-difluoropropoxy)-dimethylsilane
CID 123170783
tert-butyl-[tert-butyl(dimethyl)silyl]oxy-dimethylsilane;but-2-yne-1,4-diol
CID 86745388
O-[2-[tert-butyl(dimethyl)silyl]oxyethyl]hydroxylamine
CID 23132349

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane?
The IUPAC name of tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane (CID 171490733) is tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane?
The canonical SMILES for tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane is CC(C)(CCC(C)(C)OO[Si](C)(C)C(C)(C)C)OO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane?
The InChIKey is GIQJCTOPHIPKMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H46O4Si2/c1-17(2,3)25(11,12)23-21-19(7,8)15-16-20(9,10)22-24-26(13,14)18(4,5)6/h15-16H2,1-14H3.
What are the key properties of tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane?
tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane has a molecular weight of 406.76 g/mol, XLogP of 7.23, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[5-[tert-butyl(dimethyl)silyl]peroxy-2,5-dimethylhexan-2-yl]peroxy-dimethylsilane is sourced from PubChem (CID 171490733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).