2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane

C24H20O2Si2 — CID 15436049

IUPAC2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane
SMILESc1ccc([Si]2(c3ccccc3)O[Si](c3ccccc3)(c3ccccc3)O2)cc1
InChIInChI=1S/C24H20O2Si2/c1-5-13-21(14-6-1)27(22-15-7-2-8-16-22)25-28(26-27,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKeyHBCMWZYBDAGGHP-UHFFFAOYSA-N
MW396.59 g/mol
LogP2.55
Rot. Bonds4

About 2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane

2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane (PubChem CID 15436049) has the molecular formula C24H20O2Si2 and a molecular weight of 396.59 g/mol. Its IUPAC name is 2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane.

Molecular Properties

Compound Name2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane
PubChem CID15436049
Molecular FormulaC24H20O2Si2
Molecular Weight396.59 g/mol
Exact Mass396.10
IUPAC Name2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane
SMILESc1ccc([Si]2(c3ccccc3)O[Si](c3ccccc3)(c3ccccc3)O2)cc1
InChIInChI=1S/C24H20O2Si2/c1-5-13-21(14-6-1)27(22-15-7-2-8-16-22)25-28(26-27,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKeyHBCMWZYBDAGGHP-UHFFFAOYSA-N
XLogP2.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.59
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane 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 2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane?
The IUPAC name of 2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane (CID 15436049) is 2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane.
What is the SMILES notation for 2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane?
The canonical SMILES for 2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane is c1ccc([Si]2(c3ccccc3)O[Si](c3ccccc3)(c3ccccc3)O2)cc1.
What is the InChIKey of 2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane?
The InChIKey is HBCMWZYBDAGGHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20O2Si2/c1-5-13-21(14-6-1)27(22-15-7-2-8-16-22)25-28(26-27,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H.
What are the key properties of 2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane?
2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane has a molecular weight of 396.59 g/mol, XLogP of 2.55, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,4-tetraphenyl-1,3,2,4-dioxadisiletane is sourced from PubChem (CID 15436049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).