tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane

C28H54O2Si2 — CID 172997371

IUPACtert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane
SMILESC=CC[Si](CC=CC(C)(C)C)(OO[Si](CC=C)(CC=CC(C)(C)C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C28H54O2Si2/c1-15-21-31(27(9,10)11,23-17-19-25(3,4)5)29-30-32(22-16-2,28(12,13)14)24-18-20-26(6,7)8/h15-20H,1-2,21-24H2,3-14H3
InChIKeyZTWUQJOLANFVFE-UHFFFAOYSA-N
MW478.91 g/mol
LogP10.00
Rot. Bonds11

About tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane

tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane (PubChem CID 172997371) has the molecular formula C28H54O2Si2 and a molecular weight of 478.91 g/mol. Its IUPAC name is tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane.

Molecular Properties

Compound Nametert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane
PubChem CID172997371
Molecular FormulaC28H54O2Si2
Molecular Weight478.91 g/mol
Exact Mass478.37
IUPAC Nametert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane
SMILESC=CC[Si](CC=CC(C)(C)C)(OO[Si](CC=C)(CC=CC(C)(C)C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C28H54O2Si2/c1-15-21-31(27(9,10)11,23-17-19-25(3,4)5)29-30-32(22-16-2,28(12,13)14)24-18-20-26(6,7)8/h15-20H,1-2,21-24H2,3-14H3
InChIKeyZTWUQJOLANFVFE-UHFFFAOYSA-N
XLogP10.00
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.91
LogP ≤ 510.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane?
The IUPAC name of tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane (CID 172997371) is tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane.
What is the SMILES notation for tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane?
The canonical SMILES for tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane is C=CC[Si](CC=CC(C)(C)C)(OO[Si](CC=C)(CC=CC(C)(C)C)C(C)(C)C)C(C)(C)C.
What is the InChIKey of tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane?
The InChIKey is ZTWUQJOLANFVFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H54O2Si2/c1-15-21-31(27(9,10)11,23-17-19-25(3,4)5)29-30-32(22-16-2,28(12,13)14)24-18-20-26(6,7)8/h15-20H,1-2,21-24H2,3-14H3.
What are the key properties of tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane?
tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane has a molecular weight of 478.91 g/mol, XLogP of 10.00, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[tert-butyl-(4,4-dimethylpent-2-enyl)-prop-2-enylsilyl]peroxy-(4,4-dimethylpent-2-enyl)-prop-2-enylsilane is sourced from PubChem (CID 172997371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).